2-[(2-methylphenyl)methylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(o-tolylmethylsulfanyl)-4-(2-thienyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[(2-methylphenyl)methylthio]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-4-thiophen-2-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(2-methylbenzyl)thio]-4-(2-thienyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C22H20N2S2 MolecularWeight: 376.5376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(CCCC3)C(=C2C#N)C4=CC=CS4

InChI

InChI=1S/C22H20N2S2/c1-15-7-2-3-8-16(15)14-26-22-18(13-23)21(20-11-6-12-25-20)17-9-4-5-10-19(17)24-22/h2-3,6-8,11-12H,4-5,9-10,14H2,1H3