(3E)-1-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one

Systemtic Name: (3E)-1-(5-ethanoyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Openeye Name: (3E)-1-(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-3-(1,3,3-trimethylindolin-2-ylidene)propan-2-one CAS Name: (3E)-1-[(5-acetyl-2-ethyl-6-methyl-4-pyrimidinyl)thio]-3-(1,3,3-trimethyl-2-indolylidene)-2-propanone IUPAC Name: (3E)-1-(5-acetyl-2-ethyl-6-methylpyrimidin-4-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Traditional Name: (3E)-1-[(5-acetyl-2-ethyl-6-methyl-pyrimidin-4-yl)thio]-3-(1,3,3-trimethylindolin-2-ylidene)acetone Formula: C23H27N3O2S MolecularWeight: 409.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)C(=O)C)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(=O)/C=C/2\C(C3=CC=CC=C3N2C)(C)C)C(=O)C)C

InChI

InChI=1S/C23H27N3O2S/c1-7-20-24-14(2)21(15(3)27)22(25-20)29-13-16(28)12-19-23(4,5)17-10-8-9-11-18(17)26(19)6/h8-12H,7,13H2,1-6H3/b19-12+