(3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxynaphthalen-2-yl)sulfonylamino]-N-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide

Systemtic Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxynaphthalen-2-yl)sulfonylamino]-N-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Openeye Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxy-2-naphthyl)sulfonylamino]-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide CAS Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxy-2-naphthalenyl)sulfonylamino]-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide IUPAC Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-[(6-methoxynaphthalen-2-yl)sulfonylamino]-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)propanamide Traditional Name: (3R)-3-(1,3-benzodioxol-5-yl)-N-(2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-3-[(6-methoxy-2-naphthyl)sulfonylamino]propionamide Formula: C36H30N4O7S MolecularWeight: 662.711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)NC(CC(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5)C6=CC7=C(C=C6)OCO7

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)N[C@H](CC(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5)C6=CC7=C(C=C6)OCO7

InChI

InChI=1S/C36H30N4O7S/c1-45-26-14-11-24-18-27(15-12-23(24)17-26)48(43,44)40-30(25-13-16-31-32(19-25)47-21-46-31)20-33(41)38-35-36(42)37-29-10-6-5-9-28(29)34(39-35)22-7-3-2-4-8-22/h2-19,30,35,40H,20-21H2,1H3,(H,37,42)(H,38,41)/t30-,35?/m1/s1