N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[sulfanylidene-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]anilino]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C19H20N4OS2 MolecularWeight: 384.5183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1C)C)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H20N4OS2/c1-12-16(13(2)23(3)22-12)11-14-6-8-15(9-7-14)20-19(25)21-18(24)17-5-4-10-26-17/h4-10H,11H2,1-3H3,(H2,20,21,24,25)