2,7,7-trimethyl-5-oxidanylidene-4-(1,3-thiazol-2-yl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2,7,7-trimethyl-5-oxidanylidene-4-(1,3-thiazol-2-yl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2,7,7-trimethyl-5-oxo-4-thiazol-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2,7,7-trimethyl-5-oxo-4-(2-thiazolyl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2,7,7-trimethyl-5-oxo-4-(1,3-thiazol-2-yl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 5-keto-2,7,7-trimethyl-4-thiazol-2-yl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=NC=CS3)C#N

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=NC=CS3)C#N

InChI

InChI=1S/C16H17N3OS/c1-9-10(8-17)13(15-18-4-5-21-15)14-11(19-9)6-16(2,3)7-12(14)20/h4-5,13,19H,6-7H2,1-3H3