3-[[5-tert-butyl-1-(2-methylpropyl)-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonyl-benzamide

Systemtic Name: 3-[[5-tert-butyl-1-(2-methylpropyl)-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonyl-benzamide Openeye Name: 3-[(5-tert-butyl-1-isobutyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-N-methylsulfonyl-benzamide CAS Name: 3-[[[[5-tert-butyl-1-(2-methylpropyl)-2-oxo-3H-1,4-benzodiazepin-3-yl]amino]-oxomethyl]amino]-N-methylsulfonylbenzamide IUPAC Name: 3-[[5-tert-butyl-1-(2-methylpropyl)-2-oxo-3H-1,4-benzodiazepin-3-yl]carbamoylamino]-N-methylsulfonylbenzamide Traditional Name: 3-[(5-tert-butyl-1-isobutyl-2-keto-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-N-mesyl-benzamide Formula: C26H33N5O5S MolecularWeight: 527.63572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C(=O)NS(=O)(=O)C)C(C)(C)C

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)C(=O)NS(=O)(=O)C)C(C)(C)C

InChI

InChI=1S/C26H33N5O5S/c1-16(2)15-31-20-13-8-7-12-19(20)21(26(3,4)5)28-22(24(31)33)29-25(34)27-18-11-9-10-17(14-18)23(32)30-37(6,35)36/h7-14,16,22H,15H2,1-6H3,(H,30,32)(H2,27,29,34)