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

Systemtic Name: 5-cyclopropyl-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-N-[3-(methylthio)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]-N-[3-(methylthio)propyl]pyrazole-4-carboxamide Formula: C21H25N5OS2 MolecularWeight: 427.5861

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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)NCCCSC)C4CC4

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCCSC)C4CC4

InChI

InChI=1S/C21H25N5OS2/c1-13-11-16(14(2)29-13)18-7-9-23-21(25-18)26-19(15-5-6-15)17(12-24-26)20(27)22-8-4-10-28-3/h7,9,11-12,15H,4-6,8,10H2,1-3H3,(H,22,27)