1-azanylethyl N'-(4-chlorophenyl)carbamimidothioate

Systemtic Name: 1-azanylethyl N'-(4-chlorophenyl)carbamimidothioate Openeye Name: 2-(1-aminoethyl)-3-(4-chlorophenyl)isothiourea CAS Name: N'-(4-chlorophenyl)carbamimidothioic acid 1-aminoethyl ester IUPAC Name: 1-aminoethyl N'-(4-chlorophenyl)carbamimidothioate Traditional Name: 2-(1-aminoethyl)-3-(4-chlorophenyl)isothiourea Formula: C9H12ClN3S MolecularWeight: 229.72968

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Descriptors Computed from Structure

Canonical SMILES:

CC(N)SC(=NC1=CC=C(C=C1)Cl)N

Isomeric SMILES

CC(N)SC(=NC1=CC=C(C=C1)Cl)N

InChI

InChI=1S/C9H12ClN3S/c1-6(11)14-9(12)13-8-4-2-7(10)3-5-8/h2-6H,11H2,1H3,(H2,12,13)