N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-[(E)-(3,4-diethoxyphenyl)methyleneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]propanamide IUPAC Name: N-[(E)-(3,4-diethoxyphenyl)methylideneamino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-[(E)-(3,4-diethoxybenzylidene)amino]-2-[(4,6-dimethylpyrimidin-2-yl)thio]propionamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=NNC(=O)C(C)SC2=NC(=CC(=N2)C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=N/NC(=O)C(C)SC2=NC(=CC(=N2)C)C)OCC

InChI

InChI=1S/C20H26N4O3S/c1-6-26-17-9-8-16(11-18(17)27-7-2)12-21-24-19(25)15(5)28-20-22-13(3)10-14(4)23-20/h8-12,15H,6-7H2,1-5H3,(H,24,25)/b21-12+