2-[[5-ethanoyl-4-(2-methoxynaphthalen-1-yl)-6-methyl-1,4-dihydropyrimidin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[5-ethanoyl-4-(2-methoxynaphthalen-1-yl)-6-methyl-1,4-dihydropyrimidin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-acetyl-4-(2-methoxy-1-naphthyl)-6-methyl-1,4-dihydropyrimidin-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-acetyl-4-(2-methoxy-1-naphthalenyl)-6-methyl-1,4-dihydropyrimidin-2-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-acetyl-4-(2-methoxynaphthalen-1-yl)-6-methyl-1,4-dihydropyrimidin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-acetyl-4-(2-methoxy-1-naphthyl)-6-methyl-1,4-dihydropyrimidin-2-yl]thio]methyl]benzonitrile Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)SCC2=CC=CC=C2C#N)C3=C(C=CC4=CC=CC=C43)OC)C(=O)C

Isomeric SMILES

CC1=C(C(N=C(N1)SCC2=CC=CC=C2C#N)C3=C(C=CC4=CC=CC=C43)OC)C(=O)C

InChI

InChI=1S/C26H23N3O2S/c1-16-23(17(2)30)25(24-21-11-7-6-8-18(21)12-13-22(24)31-3)29-26(28-16)32-15-20-10-5-4-9-19(20)14-27/h4-13,25H,15H2,1-3H3,(H,28,29)