(phenylmethyl) N-(phenylcarbamoylamino)-N'-propyl-carbamimidothioate

Systemtic Name: (phenylmethyl) N-(phenylcarbamoylamino)-N'-propyl-carbamimidothioate Openeye Name: 1-[(C-benzylsulfanyl-N-propyl-carbonimidoyl)amino]-3-phenyl-urea CAS Name: N-[[anilino(oxo)methyl]amino]-N'-propylcarbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N-(phenylcarbamoylamino)-N'-propylcarbamimidothioate Traditional Name: 1-[[C-(benzylthio)-N-propyl-carbonimidoyl]amino]-3-phenyl-urea Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(NNC(=O)NC1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

CCCN=C(NNC(=O)NC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4OS/c1-2-13-19-18(24-14-15-9-5-3-6-10-15)22-21-17(23)20-16-11-7-4-8-12-16/h3-12H,2,13-14H2,1H3,(H,19,22)(H2,20,21,23)