methyl N'-[3-(2-azanylethyl)phenyl]carbamimidothioate

Systemtic Name: methyl N'-[3-(2-azanylethyl)phenyl]carbamimidothioate Openeye Name: 3-[3-(2-aminoethyl)phenyl]-2-methyl-isothiourea CAS Name: N'-[3-(2-aminoethyl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[3-(2-aminoethyl)phenyl]carbamimidothioate Traditional Name: 3-[3-(2-aminoethyl)phenyl]-2-methyl-isothiourea Formula: C10H15N3S MolecularWeight: 209.3112

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC(=C1)CCN)N

Isomeric SMILES

CSC(=NC1=CC=CC(=C1)CCN)N

InChI

InChI=1S/C10H15N3S/c1-14-10(12)13-9-4-2-3-8(7-9)5-6-11/h2-4,7H,5-6,11H2,1H3,(H2,12,13)