7-chloranyl-5-phenyl-1-[2-(phenylsulfonyl)ethyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-phenyl-1-[2-(phenylsulfonyl)ethyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 1-[2-(benzenesulfonyl)ethyl]-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-[2-(benzenesulfonyl)ethyl]-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-[2-(benzenesulfonyl)ethyl]-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(2-besylethyl)-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C23H19ClN2O3S MolecularWeight: 438.92656

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H19ClN2O3S/c24-18-11-12-21-20(15-18)23(17-7-3-1-4-8-17)25-16-22(27)26(21)13-14-30(28,29)19-9-5-2-6-10-19/h1-12,15H,13-14,16H2