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

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-4-methyl-valeramide Formula: C27H31N5O5S MolecularWeight: 537.63054

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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=CC=CC=C3C(=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=CC=CC=C3C(=N2)C4=CC=CC=C4)C

InChI

InChI=1S/C27H31N5O5S/c1-16(2)15-21(31-38(35,36)24-17(3)30-37-18(24)4)26(33)29-25-27(34)32(5)22-14-10-9-13-20(22)23(28-25)19-11-7-6-8-12-19/h6-14,16,21,25,31H,15H2,1-5H3,(H,29,33)