N-(2-acetamidoethyl)-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide Openeye Name: N-(2-acetamidoethyl)-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide CAS Name: N-(2-acetamidoethyl)-1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-(2-acetamidoethyl)-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-5-methylpyrazole-4-carboxamide Traditional Name: N-(2-acetamidoethyl)-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-5-methyl-pyrazole-4-carboxamide Formula: C19H22N6O2S MolecularWeight: 398.48198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCNC(=O)C)C

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCNC(=O)C)C

InChI

InChI=1S/C19H22N6O2S/c1-11-9-15(13(3)28-11)17-5-6-22-19(24-17)25-12(2)16(10-23-25)18(27)21-8-7-20-14(4)26/h5-6,9-10H,7-8H2,1-4H3,(H,20,26)(H,21,27)