N-(3-ethylphenyl)-6-[(E)-2-phenylethenyl]-2-sulfanylidene-1H-pyrimidine-4-carboxamide

Systemtic Name: N-(3-ethylphenyl)-6-[(E)-2-phenylethenyl]-2-sulfanylidene-1H-pyrimidine-4-carboxamide Openeye Name: N-(3-ethylphenyl)-6-[(E)-styryl]-2-thioxo-1H-pyrimidine-4-carboxamide CAS Name: N-(3-ethylphenyl)-6-[(E)-2-phenylethenyl]-2-sulfanylidene-1H-pyrimidine-4-carboxamide IUPAC Name: N-(3-ethylphenyl)-6-[(E)-2-phenylethenyl]-2-sulfanylidene-1H-pyrimidine-4-carboxamide Traditional Name: N-(3-ethylphenyl)-6-[(E)-styryl]-2-thioxo-1H-pyrimidine-4-carboxamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=NC(=S)NC(=C2)C=CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=NC(=S)NC(=C2)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H19N3OS/c1-2-15-9-6-10-17(13-15)22-20(25)19-14-18(23-21(26)24-19)12-11-16-7-4-3-5-8-16/h3-14H,2H2,1H3,(H,22,25)(H,23,24,26)/b12-11+