N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-[4-(3-nitrophenyl)thiazol-2-yl]acetamide Formula: C18H17N5O4S2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4S2/c1-2-4-12-8-15(24)21-17(19-12)29-10-16(25)22-18-20-14(9-28-18)11-5-3-6-13(7-11)23(26)27/h3,5-9H,2,4,10H2,1H3,(H,19,21,24)(H,20,22,25)