N-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-4-methyl-pentanamide

Systemtic Name: N-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-4-methyl-pentanamide Openeye Name: N-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-4-methyl-pentanamide CAS Name: N-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-4-methylpentanamide IUPAC Name: N-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-4-methylpentanamide Traditional Name: N-(7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-4-methyl-valeramide Formula: C27H30ClN5O5S MolecularWeight: 572.0756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC(CC(C)C)C(=O)NC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NC(CC(C)C)C(=O)NC2C(=O)N(C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C27H30ClN5O5S/c1-15(2)13-21(32-39(36,37)24-16(3)31-38-17(24)4)26(34)30-25-27(35)33(5)22-12-11-19(28)14-20(22)23(29-25)18-9-7-6-8-10-18/h6-12,14-15,21,25,32H,13H2,1-5H3,(H,30,34)