2-[(3-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide

Systemtic Name: 2-[(3-bromanyl-5-chloranyl-thiophen-2-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Openeye Name: 2-[(3-bromo-5-chloro-2-thienyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide CAS Name: 2-[(3-bromo-5-chloro-2-thiophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide IUPAC Name: 2-[(3-bromo-5-chlorothiophen-2-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Traditional Name: 2-[(3-bromo-5-chloro-2-thienyl)sulfonylamino]-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-4-methyl-valeramide Formula: C26H26BrClN4O4S2 MolecularWeight: 637.99604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)NS(=O)(=O)C4=C(C=C(S4)Cl)Br

Isomeric SMILES

CC(C)CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)NS(=O)(=O)C4=C(C=C(S4)Cl)Br

InChI

InChI=1S/C26H26BrClN4O4S2/c1-15(2)13-19(31-38(35,36)26-18(27)14-21(28)37-26)24(33)30-23-25(34)32(3)20-12-8-7-11-17(20)22(29-23)16-9-5-4-6-10-16/h4-12,14-15,19,23,31H,13H2,1-3H3,(H,30,33)