(3S)-3-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-1,4-benzodiazepin-5-one

Systemtic Name: (3S)-3-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-1,4-benzodiazepin-5-one Openeye Name: (3S)-3-benzyl-2-thioxo-3,4-dihydro-1H-1,4-benzodiazepin-5-one CAS Name: (3S)-3-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-1,4-benzodiazepin-5-one IUPAC Name: (3S)-3-benzyl-2-sulfanylidene-3,4-dihydro-1H-1,4-benzodiazepin-5-one Traditional Name: (3S)-3-benzyl-2-thioxo-3,4-dihydro-1H-1,4-benzodiazepin-5-one Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=S)NC3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2C(=S)NC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C16H14N2OS/c19-15-12-8-4-5-9-13(12)18-16(20)14(17-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,19)(H,18,20)/t14-/m0/s1