N-(3-methylbut-2-enyl)-1-[(4-methylsulfanylphenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidin-3-amine

Systemtic Name: N-(3-methylbut-2-enyl)-1-[(4-methylsulfanylphenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidin-3-amine Openeye Name: N-(4-benzyloxyphenyl)-N-(3-methylbut-2-enyl)-1-[(4-methylsulfanylphenyl)methyl]piperidin-3-amine CAS Name: N-(3-methylbut-2-enyl)-1-[[4-(methylthio)phenyl]methyl]-N-(4-phenylmethoxyphenyl)-3-piperidinamine IUPAC Name: N-(3-methylbut-2-enyl)-1-[(4-methylsulfanylphenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidin-3-amine Traditional Name: (4-benzoxyphenyl)-(3-methylbut-2-enyl)-[1-[4-(methylthio)benzyl]-3-piperidyl]amine Formula: C31H38N2OS MolecularWeight: 486.71122

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN(C1CCCN(C1)CC2=CC=C(C=C2)SC)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CC(=CCN(C1CCCN(C1)CC2=CC=C(C=C2)SC)C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C31H38N2OS/c1-25(2)19-21-33(28-13-15-30(16-14-28)34-24-27-8-5-4-6-9-27)29-10-7-20-32(23-29)22-26-11-17-31(35-3)18-12-26/h4-6,8-9,11-19,29H,7,10,20-24H2,1-3H3