(2-chlorophenyl)methyl N-cyano-N'-(4-ethoxyphenyl)carbamimidothioate

Systemtic Name: (2-chlorophenyl)methyl N-cyano-N'-(4-ethoxyphenyl)carbamimidothioate Openeye Name: 2-[(2-chlorophenyl)methyl]-1-cyano-3-(4-ethoxyphenyl)isothiourea CAS Name: N-cyano-N'-(4-ethoxyphenyl)carbamimidothioic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl N-cyano-N'-(4-ethoxyphenyl)carbamimidothioate Traditional Name: 2-(2-chlorobenzyl)-1-cyano-3-p-phenetyl-isothiourea Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C(NC#N)SCC2=CC=CC=C2Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C(NC#N)SCC2=CC=CC=C2Cl

InChI

InChI=1S/C17H16ClN3OS/c1-2-22-15-9-7-14(8-10-15)21-17(20-12-19)23-11-13-5-3-4-6-16(13)18/h3-10H,2,11H2,1H3,(H,20,21)