(5Z)-5-[5-methyl-2-[(3-phenylmethoxyphenyl)amino]-1H-pyrimidin-6-ylidene]-4-phenyl-thiophen-2-one

Systemtic Name: (5Z)-5-[5-methyl-2-[(3-phenylmethoxyphenyl)amino]-1H-pyrimidin-6-ylidene]-4-phenyl-thiophen-2-one Openeye Name: (5Z)-5-[2-(3-benzyloxyanilino)-5-methyl-1H-pyrimidin-6-ylidene]-4-phenyl-thiophen-2-one CAS Name: (5Z)-5-[5-methyl-2-(3-phenylmethoxyanilino)-1H-pyrimidin-6-ylidene]-4-phenyl-2-thiophenone IUPAC Name: (5Z)-5-[5-methyl-2-(3-phenylmethoxyanilino)-1H-pyrimidin-6-ylidene]-4-phenylthiophen-2-one Traditional Name: (5Z)-5-[2-(3-benzoxyanilino)-5-methyl-1H-pyrimidin-6-ylidene]-4-phenyl-thiophen-2-one Formula: C28H23N3O2S MolecularWeight: 465.56612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(NC1=C2C(=CC(=O)S2)C3=CC=CC=C3)NC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC\1=CN=C(N/C1=C\2/C(=CC(=O)S2)C3=CC=CC=C3)NC4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H23N3O2S/c1-19-17-29-28(30-22-13-8-14-23(15-22)33-18-20-9-4-2-5-10-20)31-26(19)27-24(16-25(32)34-27)21-11-6-3-7-12-21/h2-17H,18H2,1H3,(H2,29,30,31)/b27-26-