phenacyl N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioate

Systemtic Name: phenacyl N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioate Openeye Name: 1-benzyl-1-methyl-2-phenacyl-3-phenyl-isothiourea CAS Name: N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioic acid phenacyl ester IUPAC Name: phenacyl N-benzyl-N-methyl-N'-phenylcarbamimidothioate Traditional Name: 1-benzyl-1-methyl-2-phenacyl-3-phenyl-isothiourea Formula: C23H22N2OS MolecularWeight: 374.49858

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=NC2=CC=CC=C2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=NC2=CC=CC=C2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22N2OS/c1-25(17-19-11-5-2-6-12-19)23(24-21-15-9-4-10-16-21)27-18-22(26)20-13-7-3-8-14-20/h2-16H,17-18H2,1H3