4-[[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzenecarbonitrile

Systemtic Name: 4-[[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzenecarbonitrile Openeye Name: 4-[[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzonitrile CAS Name: 4-[[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzonitrile IUPAC Name: 4-[[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzonitrile Traditional Name: 4-[[(4R)-2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]sulfonyl]benzonitrile Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H]1CC(=O)NC2=CC=CC=C2N1S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H15N3O3S/c1-12-10-17(21)19-15-4-2-3-5-16(15)20(12)24(22,23)14-8-6-13(11-18)7-9-14/h2-9,12H,10H2,1H3,(H,19,21)/t12-/m1/s1