5-[(5-cyclohexyl-1-methyl-2-oxidanylidene-5H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-methylsulfonyl-benzamide

Systemtic Name: 5-[(5-cyclohexyl-1-methyl-2-oxidanylidene-5H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-methylsulfonyl-benzamide Openeye Name: 5-[(5-cyclohexyl-1-methyl-2-oxo-5H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-methylsulfonyl-benzamide CAS Name: 5-[[[(5-cyclohexyl-1-methyl-2-oxo-5H-1,4-benzodiazepin-3-yl)amino]-oxomethyl]amino]-2-methyl-N-methylsulfonylbenzamide IUPAC Name: 5-[(5-cyclohexyl-1-methyl-2-oxo-5H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-methylsulfonylbenzamide Traditional Name: 5-[(5-cyclohexyl-2-keto-1-methyl-5H-1,4-benzodiazepin-3-yl)carbamoylamino]-N-mesyl-2-methyl-benzamide Formula: C26H31N5O5S MolecularWeight: 525.61984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NC(C3=CC=CC=C3N(C2=O)C)C4CCCCC4)C(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NC(C3=CC=CC=C3N(C2=O)C)C4CCCCC4)C(=O)NS(=O)(=O)C

InChI

InChI=1S/C26H31N5O5S/c1-16-13-14-18(15-20(16)24(32)30-37(3,35)36)27-26(34)29-23-25(33)31(2)21-12-8-7-11-19(21)22(28-23)17-9-5-4-6-10-17/h7-8,11-15,17,22H,4-6,9-10H2,1-3H3,(H,30,32)(H2,27,28,29,34)