3-(imidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)aniline

Systemtic Name: 3-(imidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)aniline Openeye Name: 3-(imidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)aniline CAS Name: 3-(1-imidazolylmethyl)-N-[3-(methylthio)propyl]aniline IUPAC Name: 3-(imidazol-1-ylmethyl)-N-(3-methylsulfanylpropyl)aniline Traditional Name: [3-(imidazol-1-ylmethyl)phenyl]-[3-(methylthio)propyl]amine Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=CC=CC(=C1)CN2C=CN=C2

Isomeric SMILES

CSCCCNC1=CC=CC(=C1)CN2C=CN=C2

InChI

InChI=1S/C14H19N3S/c1-18-9-3-6-16-14-5-2-4-13(10-14)11-17-8-7-15-12-17/h2,4-5,7-8,10,12,16H,3,6,9,11H2,1H3