2-azanyl-4-(4-methylsulfanylphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-methylsulfanylphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-methylsulfanylphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[4-(methylthio)phenyl]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-methylsulfanylphenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[4-(methylthio)phenyl]-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H21N3S MolecularWeight: 371.49794

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C4=CC=CC=C4)N)C#N

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(=NC3=C2CC(CC3)C4=CC=CC=C4)N)C#N

InChI

InChI=1S/C23H21N3S/c1-27-18-10-7-16(8-11-18)22-19-13-17(15-5-3-2-4-6-15)9-12-21(19)26-23(25)20(22)14-24/h2-8,10-11,17H,9,12-13H2,1H3,(H2,25,26)