4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C16H14N6O2S2 MolecularWeight: 386.45136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)SC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)SC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C16H14N6O2S2/c1-20-13(23)10(8-17)14(21(2)16(20)24)26-15-19-18-12(11-4-3-7-25-11)22(15)9-5-6-9/h3-4,7,9H,5-6H2,1-2H3