N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C18H18N4O5S2 MolecularWeight: 434.48932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC(=CC(=O)N3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=NC(=CC(=O)N3)O)OC

InChI

InChI=1S/C18H18N4O5S2/c1-26-12-4-3-10(7-13(12)27-2)11-9-29-17(19-11)20-14(23)5-6-28-18-21-15(24)8-16(25)22-18/h3-4,7-9H,5-6H2,1-2H3,(H,19,20,23)(H2,21,22,24,25)