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

Systemtic Name: 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]-N-(5-butyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H22N6O2S2 MolecularWeight: 394.51488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C(C)SC2=NC(=O)C=C(N2CC=C)N

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C(C)SC2=NC(=O)C=C(N2CC=C)N

InChI

InChI=1S/C16H22N6O2S2/c1-4-6-7-13-20-21-15(26-13)19-14(24)10(3)25-16-18-12(23)9-11(17)22(16)8-5-2/h5,9-10H,2,4,6-8,17H2,1,3H3,(H,19,21,24)