1-[1,5-bis(oxidanylidene)-2H-2,4-benzodiazepin-3-yl]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[1,5-bis(oxidanylidene)-2H-2,4-benzodiazepin-3-yl]-3-(4-chlorophenyl)thiourea Openeye Name: 1-(4-chlorophenyl)-3-(1,5-dioxo-2H-2,4-benzodiazepin-3-yl)thiourea CAS Name: 1-(4-chlorophenyl)-3-(1,5-dioxo-2H-2,4-benzodiazepin-3-yl)thiourea IUPAC Name: 1-(4-chlorophenyl)-3-(1,5-dioxo-2H-2,4-benzodiazepin-3-yl)thiourea Traditional Name: 1-(4-chlorophenyl)-3-(1,5-diketo-2H-2,4-benzodiazepin-3-yl)thiourea Formula: C16H11ClN4O2S MolecularWeight: 358.80214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=NC2=O)NC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(=NC2=O)NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H11ClN4O2S/c17-9-5-7-10(8-6-9)18-16(24)21-15-19-13(22)11-3-1-2-4-12(11)14(23)20-15/h1-8H,(H3,18,19,20,21,22,23,24)