1-[5-(aminocarbamoyl)-4-ethanoyl-cyclohexa-1,5-dien-1-yl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[5-(aminocarbamoyl)-4-ethanoyl-cyclohexa-1,5-dien-1-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-[4-acetyl-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-benzyl-thiourea CAS Name: 1-[4-acetyl-5-(hydrazinecarbonyl)-1-cyclohexa-1,5-dienyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-[4-acetyl-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-benzylthiourea Traditional Name: 1-(4-acetyl-5-carbazoyl-cyclohexa-1,5-dien-1-yl)-3-benzyl-thiourea Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC=C(C=C1C(=O)NN)NC(=S)NCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1CC=C(C=C1C(=O)NN)NC(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C17H20N4O2S/c1-11(22)14-8-7-13(9-15(14)16(23)21-18)20-17(24)19-10-12-5-3-2-4-6-12/h2-7,9,14H,8,10,18H2,1H3,(H,21,23)(H2,19,20,24)