1-[2-(3,4-dimethoxyphenyl)ethyl-(phenylmethyl)amino]-3-naphthalen-1-ylsulfanyl-propan-2-ol

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl-(phenylmethyl)amino]-3-naphthalen-1-ylsulfanyl-propan-2-ol Openeye Name: 1-[benzyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-3-(1-naphthylsulfanyl)propan-2-ol CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl-(phenylmethyl)amino]-3-(1-naphthalenylthio)-2-propanol IUPAC Name: 1-[benzyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-3-naphthalen-1-ylsulfanylpropan-2-ol Traditional Name: 1-[benzyl(homoveratryl)amino]-3-(1-naphthylthio)propan-2-ol Formula: C30H33NO3S MolecularWeight: 487.65292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=C2)CC(CSC3=CC=CC4=CC=CC=C43)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC=CC=C2)CC(CSC3=CC=CC4=CC=CC=C43)O)OC

InChI

InChI=1S/C30H33NO3S/c1-33-28-16-15-23(19-29(28)34-2)17-18-31(20-24-9-4-3-5-10-24)21-26(32)22-35-30-14-8-12-25-11-6-7-13-27(25)30/h3-16,19,26,32H,17-18,20-22H2,1-2H3