(3E)-1-(1-methylimidazol-2-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one

Systemtic Name: (3E)-1-(1-methylimidazol-2-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Openeye Name: (3E)-1-(1-methylimidazol-2-yl)sulfanyl-3-(1,3,3-trimethylindolin-2-ylidene)propan-2-one CAS Name: (3E)-1-[(1-methyl-2-imidazolyl)thio]-3-(1,3,3-trimethyl-2-indolylidene)-2-propanone IUPAC Name: (3E)-1-(1-methylimidazol-2-yl)sulfanyl-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Traditional Name: (3E)-1-[(1-methylimidazol-2-yl)thio]-3-(1,3,3-trimethylindolin-2-ylidene)acetone Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=NC=CN3C)C)C

Isomeric SMILES

CC\1(C2=CC=CC=C2N(/C1=C/C(=O)CSC3=NC=CN3C)C)C

InChI

InChI=1S/C18H21N3OS/c1-18(2)14-7-5-6-8-15(14)21(4)16(18)11-13(22)12-23-17-19-9-10-20(17)3/h5-11H,12H2,1-4H3/b16-11+