2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methyl-amino]-2-phenylsulfanyl-pentanenitrile

Systemtic Name: 2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methyl-amino]-2-phenylsulfanyl-pentanenitrile Openeye Name: 2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methyl-amino]-2-phenylsulfanyl-pentanenitrile CAS Name: 2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methylamino]-2-(phenylthio)pentanenitrile IUPAC Name: 2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methylamino]-2-phenylsulfanylpentanenitrile Traditional Name: 2-(2-methoxyphenyl)-5-[1-(8-methoxy-1,2,3,4-tetrahydroquinolin-5-yl)ethyl-methyl-amino]-2-(phenylthio)valeronitrile Formula: C31H37N3O2S MolecularWeight: 515.70938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2CCCNC2=C(C=C1)OC)N(C)CCCC(C#N)(C3=CC=CC=C3OC)SC4=CC=CC=C4

Isomeric SMILES

CC(C1=C2CCCNC2=C(C=C1)OC)N(C)CCCC(C#N)(C3=CC=CC=C3OC)SC4=CC=CC=C4

InChI

InChI=1S/C31H37N3O2S/c1-23(25-17-18-29(36-4)30-26(25)14-10-20-33-30)34(2)21-11-19-31(22-32,37-24-12-6-5-7-13-24)27-15-8-9-16-28(27)35-3/h5-9,12-13,15-18,23,33H,10-11,14,19-21H2,1-4H3