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

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C15H14N4O3S2 MolecularWeight: 362.42666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NC(=CC(=O)N3)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NC(=CC(=O)N3)O

InChI

InChI=1S/C15H14N4O3S2/c1-8-2-3-9-10(6-8)24-15(16-9)17-11(20)4-5-23-14-18-12(21)7-13(22)19-14/h2-3,6-7H,4-5H2,1H3,(H,16,17,20)(H2,18,19,21,22)