2-(6-azanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 2-(6-amino-4-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 2-[(6-amino-4-oxo-1-phenyl-2-pyrimidinyl)thio]-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 2-(6-amino-4-oxo-1-phenylpyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 2-[(6-amino-4-keto-1-phenyl-pyrimidin-2-yl)thio]-N-(5-butyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C19H22N6O2S2 MolecularWeight: 430.54698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C(C)SC2=NC(=O)C=C(N2C3=CC=CC=C3)N

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C(C)SC2=NC(=O)C=C(N2C3=CC=CC=C3)N

InChI

InChI=1S/C19H22N6O2S2/c1-3-4-10-16-23-24-18(29-16)22-17(27)12(2)28-19-21-15(26)11-14(20)25(19)13-8-6-5-7-9-13/h5-9,11-12H,3-4,10,20H2,1-2H3,(H,22,24,27)