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K2C

Summary
Name:6,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one
Formula:C20 H13 N3 O
Formal charge:0
Formula weight:311.337 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.046,7,12,13-tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C5c4c1c6c(nc1c3c(c2ccccc2n3)c4CN5)cccc6
SMILES_CANONICALCACTVS3.341O=C1NCc2c1c3c([nH]c4ccccc34)c5[nH]c6ccccc6c25
SMILESCACTVS3.341O=C1NCc2c1c3c([nH]c4ccccc34)c5[nH]c6ccccc6c25
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc2c(c1)c3c4c(c5c6ccccc6[nH]c5c3[nH]2)C(=O)NC4
SMILESOpenEye OEToolkits1.5.0c1ccc2c(c1)c3c4c(c5c6ccccc6[nH]c5c3[nH]2)C(=O)NC4
InChIInChI1.03InChI=1S/C20H13N3O/c24-20-17-12(9-21-20)15-10-5-1-3-7-13(10)22-18(15)19-16(17)11-6-2-4-8-14(11)23-19/h1-8,22-23H,9H2,(H,21,24)
InChIKeyInChI1.03MEXUTNIFSHFQRG-UHFFFAOYSA-N

218500

PDB entries from 2024-04-17

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