6-(4-methylpiperidin-1-yl)-4-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-methylpiperidin-1-yl)-4-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-methyl-1-piperidyl)-4-oxo-2-(3-thienylmethyl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-methyl-1-piperidinyl)-4-oxo-2-(3-thiophenylmethyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-methylpiperidin-1-yl)-4-oxo-2-(thiophen-3-ylmethyl)-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-methylpiperidino)-2-(3-thenyl)-1H-pyrimidine-5-carbonitrile Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=O)N=C(N2)CC3=CSC=C3)C#N

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=O)N=C(N2)CC3=CSC=C3)C#N

InChI

InChI=1S/C16H18N4OS/c1-11-2-5-20(6-3-11)15-13(9-17)16(21)19-14(18-15)8-12-4-7-22-10-12/h4,7,10-11H,2-3,5-6,8H2,1H3,(H,18,19,21)