[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioate Openeye Name: 2-(N-benzyl-N-methyl-N'-phenyl-carbamimidoyl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: N-methyl-N'-phenyl-N-(phenylmethyl)carbamimidothioic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] N-benzyl-N-methyl-N'-phenylcarbamimidothioate Traditional Name: 2-[(N-benzyl-N-methyl-N'-phenyl-amidino)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C26H29N3OS MolecularWeight: 431.59296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC(=NC2=CC=CC=C2)N(C)CC3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC(=NC2=CC=CC=C2)N(C)CC3=CC=CC=C3)C

InChI

InChI=1S/C26H29N3OS/c1-4-22-15-11-12-20(2)25(22)28-24(30)19-31-26(27-23-16-9-6-10-17-23)29(3)18-21-13-7-5-8-14-21/h5-17H,4,18-19H2,1-3H3,(H,28,30)