2-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-[(2,5-diketo-1-phenyl-pyrrolidin-3-yl)thio]-6-methyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SC3CC(=O)N(C3=O)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SC3CC(=O)N(C3=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H19N3O2S/c1-13-7-8-17-14(9-13)10-15(12-22)20(23-17)27-18-11-19(25)24(21(18)26)16-5-3-2-4-6-16/h2-6,10,13,18H,7-9,11H2,1H3