(3-chlorophenyl)methyl N'-(cycloheptylideneamino)carbamimidothioate

Systemtic Name: (3-chlorophenyl)methyl N'-(cycloheptylideneamino)carbamimidothioate Openeye Name: 2-[(3-chlorophenyl)methyl]-3-(cycloheptylideneamino)isothiourea CAS Name: N'-(cycloheptylideneamino)carbamimidothioic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl N'-(cycloheptylideneamino)carbamimidothioate Traditional Name: 2-(3-chlorobenzyl)-3-(cycloheptylideneamino)isothiourea Formula: C15H20ClN3S MolecularWeight: 309.8574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=NN=C(N)SCC2=CC(=CC=C2)Cl)CC1

Isomeric SMILES

C1CCCC(=N/N=C(/N)\SCC2=CC(=CC=C2)Cl)CC1

InChI

InChI=1S/C15H20ClN3S/c16-13-7-5-6-12(10-13)11-20-15(17)19-18-14-8-3-1-2-4-9-14/h5-7,10H,1-4,8-9,11H2,(H2,17,19)