3-[[5-(2,2-diethoxyethyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonyl-benzamide

Systemtic Name: 3-[[5-(2,2-diethoxyethyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonyl-benzamide Openeye Name: 3-[[5-(2,2-diethoxyethyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonyl-benzamide CAS Name: 3-[[[[5-(2,2-diethoxyethyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-oxomethyl]amino]-N-methylsulfonylbenzamide IUPAC Name: 3-[[5-(2,2-diethoxyethyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonylbenzamide Traditional Name: 3-[[5-(2,2-diethoxyethyl)-4-keto-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-N-mesyl-benzamide Formula: C30H35N5O7S MolecularWeight: 609.6932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC3=CC=CC(=C3)C(=O)NS(=O)(=O)C)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC(CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NC3=CC=CC(=C3)C(=O)NS(=O)(=O)C)C4=CC=CC=C4)OCC

InChI

InChI=1S/C30H35N5O7S/c1-4-41-27(42-5-2)20-35-26-17-10-9-16-25(26)34(23-14-7-6-8-15-23)19-24(29(35)37)32-30(38)31-22-13-11-12-21(18-22)28(36)33-43(3,39)40/h6-18,24,27H,4-5,19-20H2,1-3H3,(H,33,36)(H2,31,32,38)