4-(2,2-dimethylpropyl)-6-methoxy-2-methylsulfanyl-quinoline

Systemtic Name: 4-(2,2-dimethylpropyl)-6-methoxy-2-methylsulfanyl-quinoline Openeye Name: 4-(2,2-dimethylpropyl)-6-methoxy-2-methylsulfanyl-quinoline CAS Name: 4-(2,2-dimethylpropyl)-6-methoxy-2-(methylthio)quinoline IUPAC Name: 4-(2,2-dimethylpropyl)-6-methoxy-2-methylsulfanylquinoline Traditional Name: 6-methoxy-2-(methylthio)-4-neopentyl-quinoline Formula: C16H21NOS MolecularWeight: 275.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC(=NC2=C1C=C(C=C2)OC)SC

Isomeric SMILES

CC(C)(C)CC1=CC(=NC2=C1C=C(C=C2)OC)SC

InChI

InChI=1S/C16H21NOS/c1-16(2,3)10-11-8-15(19-5)17-14-7-6-12(18-4)9-13(11)14/h6-9H,10H2,1-5H3