1-piperidin-1-yl-3-(2-piperidin-1-ylethylsulfanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 1-piperidin-1-yl-3-(2-piperidin-1-ylethylsulfanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 1-(1-piperidyl)-3-[2-(1-piperidyl)ethylsulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 1-(1-piperidinyl)-3-[2-(1-piperidinyl)ethylthio]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 1-piperidin-1-yl-3-(2-piperidin-1-ylethylsulfanyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 1-piperidino-3-(2-piperidinoethylthio)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C22H32N4S MolecularWeight: 384.58128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCSC2=NC(=C3CCCCC3=C2C#N)N4CCCCC4

Isomeric SMILES

C1CCN(CC1)CCSC2=NC(=C3CCCCC3=C2C#N)N4CCCCC4

InChI

InChI=1S/C22H32N4S/c23-17-20-18-9-3-4-10-19(18)21(26-13-7-2-8-14-26)24-22(20)27-16-15-25-11-5-1-6-12-25/h1-16H2