2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 2-[6-amino-1-(m-tolyl)-4-oxo-pyrimidin-2-yl]sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 2-[[6-amino-1-(3-methylphenyl)-4-oxo-2-pyrimidinyl]thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 2-[[6-amino-4-keto-1-(m-tolyl)pyrimidin-2-yl]thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C18H20N6O2S2 MolecularWeight: 416.5204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)C)SC2=NC(=O)C=C(N2C3=CC=CC(=C3)C)N

Isomeric SMILES

CCC(C(=O)NC1=NN=C(S1)C)SC2=NC(=O)C=C(N2C3=CC=CC(=C3)C)N

InChI

InChI=1S/C18H20N6O2S2/c1-4-13(16(26)21-17-23-22-11(3)27-17)28-18-20-15(25)9-14(19)24(18)12-7-5-6-10(2)8-12/h5-9,13H,4,19H2,1-3H3,(H,21,23,26)