2-[(4-azanyl-2-methyl-phenyl)amino]-3-(phenylmethylsulfanyl)propan-1-ol

Systemtic Name: 2-[(4-azanyl-2-methyl-phenyl)amino]-3-(phenylmethylsulfanyl)propan-1-ol Openeye Name: 2-(4-amino-2-methyl-anilino)-3-benzylsulfanyl-propan-1-ol CAS Name: 2-(4-amino-2-methylanilino)-3-(phenylmethylthio)-1-propanol IUPAC Name: 2-(4-amino-2-methylanilino)-3-benzylsulfanylpropan-1-ol Traditional Name: 2-(4-amino-2-methyl-anilino)-3-(benzylthio)propan-1-ol Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)NC(CO)CSCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)N)NC(CO)CSCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2OS/c1-13-9-15(18)7-8-17(13)19-16(10-20)12-21-11-14-5-3-2-4-6-14/h2-9,16,19-20H,10-12,18H2,1H3