6-methyl-2-(2-oxidanylidenepropylsulfanyl)-4-(2,4,5-trimethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-(2-oxidanylidenepropylsulfanyl)-4-(2,4,5-trimethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Openeye Name: 2-acetonylsulfanyl-6-methyl-4-(2,4,5-trimethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile CAS Name: 6-methyl-2-(2-oxopropylthio)-4-(2,4,5-trimethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile IUPAC Name: 6-methyl-2-(2-oxopropylsulfanyl)-4-(2,4,5-trimethoxyphenyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Traditional Name: 2-(acetonylthio)-4-asaryl-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(CN(CC2)C)C(=C1C#N)C3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CC(=O)CSC1=NC2=C(CN(CC2)C)C(=C1C#N)C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C22H25N3O4S/c1-13(26)12-30-22-15(10-23)21(16-11-25(2)7-6-17(16)24-22)14-8-19(28-4)20(29-5)9-18(14)27-3/h8-9H,6-7,11-12H2,1-5H3