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

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]methanesulfonamide 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]methanesulfonamide 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]methanesulfonamide 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]methanesulfonamide 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]methanesulfonamide Formula: C19H19N3O4S MolecularWeight: 385.43686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1CC2C(=O)NC3=C(C=C(C=C3)C4=CC=CC=C4)C(=O)N2C1

Isomeric SMILES

CS(=O)(=O)N[C@H]1C[C@H]2C(=O)NC3=C(C=C(C=C3)C4=CC=CC=C4)C(=O)N2C1

InChI

InChI=1S/C19H19N3O4S/c1-27(25,26)21-14-10-17-18(23)20-16-8-7-13(12-5-3-2-4-6-12)9-15(16)19(24)22(17)11-14/h2-9,14,17,21H,10-11H2,1H3,(H,20,23)/t14-,17-/m0/s1