1-(1,3,3-trimethylindol-2-ylidene)-3-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-2-one

Systemtic Name: 1-(1,3,3-trimethylindol-2-ylidene)-3-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-2-one Openeye Name: 1-(1,3,3-trimethylindolin-2-ylidene)-3-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-2-one CAS Name: 1-(1,3,3-trimethyl-2-indolylidene)-3-[(4,5,6-trimethyl-2-pyrimidinyl)thio]-2-propanone IUPAC Name: 1-(1,3,3-trimethylindol-2-ylidene)-3-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropan-2-one Traditional Name: 1-(1,3,3-trimethylindolin-2-ylidene)-3-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetone Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C)C

InChI

InChI=1S/C21H25N3OS/c1-13-14(2)22-20(23-15(13)3)26-12-16(25)11-19-21(4,5)17-9-7-8-10-18(17)24(19)6/h7-11H,12H2,1-6H3