N-[(6aS,8S)-6,11-bis(oxidanylidene)-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[(6aS,8S)-6,11-bis(oxidanylidene)-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[(6aS,8S)-6,11-dioxo-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[(6aS,8S)-6,11-dioxo-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[(6aS,8S)-6,11-dioxo-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[(6aS,8S)-6,11-diketo-2-phenyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]-1-methyl-pyrrole-2-carboxamide Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC2CC3C(=O)NC4=C(C=C(C=C4)C5=CC=CC=C5)C(=O)N3C2

Isomeric SMILES

CN1C=CC=C1C(=O)N[C@H]2C[C@H]3C(=O)NC4=C(C=C(C=C4)C5=CC=CC=C5)C(=O)N3C2

InChI

InChI=1S/C24H22N4O3/c1-27-11-5-8-20(27)22(29)25-17-13-21-23(30)26-19-10-9-16(15-6-3-2-4-7-15)12-18(19)24(31)28(21)14-17/h2-12,17,21H,13-14H2,1H3,(H,25,29)(H,26,30)/t17-,21-/m0/s1