N-[3-(4-chlorophenyl)propyl]imidazole-1-carbothioamide

Systemtic Name: N-[3-(4-chlorophenyl)propyl]imidazole-1-carbothioamide Openeye Name: N-[3-(4-chlorophenyl)propyl]imidazole-1-carbothioamide CAS Name: N-[3-(4-chlorophenyl)propyl]-1-imidazolecarbothioamide IUPAC Name: N-[3-(4-chlorophenyl)propyl]imidazole-1-carbothioamide Traditional Name: N-[3-(4-chlorophenyl)propyl]imidazole-1-carbothioamide Formula: C13H14ClN3S MolecularWeight: 279.78836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCNC(=S)N2C=CN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1CCCNC(=S)N2C=CN=C2)Cl

InChI

InChI=1S/C13H14ClN3S/c14-12-5-3-11(4-6-12)2-1-7-16-13(18)17-9-8-15-10-17/h3-6,8-10H,1-2,7H2,(H,16,18)