N-methyl-4-[(phenylmethylsulfanyl)methyl]aniline; (phenylmethylsulfanyl)methanol

Systemtic Name: N-methyl-4-[(phenylmethylsulfanyl)methyl]aniline; (phenylmethylsulfanyl)methanol Openeye Name: benzylsulfanylmethanol; 4-(benzylsulfanylmethyl)-N-methyl-aniline CAS Name: N-methyl-4-[(phenylmethylthio)methyl]aniline; (phenylmethylthio)methanol IUPAC Name: benzylsulfanylmethanol; 4-(benzylsulfanylmethyl)-N-methylaniline Traditional Name: (benzylthio)methanol; [4-[(benzylthio)methyl]phenyl]-methyl-amine Formula: C23H27NOS2 MolecularWeight: 397.59658

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)CSCC2=CC=CC=C2.C1=CC=C(C=C1)CSCO

Isomeric SMILES

CNC1=CC=C(C=C1)CSCC2=CC=CC=C2.C1=CC=C(C=C1)CSCO

InChI

InChI=1S/C15H17NS.C8H10OS/c1-16-15-9-7-14(8-10-15)12-17-11-13-5-3-2-4-6-13;9-7-10-6-8-4-2-1-3-5-8/h2-10,16H,11-12H2,1H3;1-5,9H,6-7H2