(6E)-3-methoxy-6-[2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-3-methoxy-6-[2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-3-methoxy-6-[2-methyl-5-(2-phenylthiazol-4-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-3-methoxy-6-[2-methyl-5-(2-phenyl-4-thiazolyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-3-methoxy-6-[2-methyl-5-(2-phenyl-1,3-thiazol-4-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-3-methoxy-6-[2-methyl-5-(2-phenylthiazol-4-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C2C=CC(=CC2=O)OC)N1)C3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC=C(/C(=C\2/C=CC(=CC2=O)OC)/N1)C3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S/c1-13-22-11-17(18-12-27-21(24-18)14-6-4-3-5-7-14)20(23-13)16-9-8-15(26-2)10-19(16)25/h3-12H,1-2H3,(H,22,23)/b20-16+