(2-chlorophenyl)methyl N'-(cyclopentylideneamino)carbamimidothioate

Systemtic Name: (2-chlorophenyl)methyl N'-(cyclopentylideneamino)carbamimidothioate Openeye Name: 2-[(2-chlorophenyl)methyl]-3-(cyclopentylideneamino)isothiourea CAS Name: N'-(cyclopentylideneamino)carbamimidothioic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl N'-(cyclopentylideneamino)carbamimidothioate Traditional Name: 2-(2-chlorobenzyl)-3-(cyclopentylideneamino)isothiourea Formula: C13H16ClN3S MolecularWeight: 281.80424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NN=C(N)SCC2=CC=CC=C2Cl)C1

Isomeric SMILES

C1CCC(=N/N=C(/N)\SCC2=CC=CC=C2Cl)C1

InChI

InChI=1S/C13H16ClN3S/c14-12-8-4-1-5-10(12)9-18-13(15)17-16-11-6-2-3-7-11/h1,4-5,8H,2-3,6-7,9H2,(H2,15,17)