2-azanylethyl N'-(3-chlorophenyl)carbamimidothioate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N=C(N)SCCN

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N=C(N)SCCN

InChI

InChI=1S/C9H12ClN3S/c10-7-2-1-3-8(6-7)13-9(12)14-5-4-11/h1-3,6H,4-5,11H2,(H2,12,13)