N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H24N4O3S2/c1-23(15-17-14-22-25(16-17)18-8-4-2-5-9-18)21(26)20-19(10-13-29-20)30(27,28)24-11-6-3-7-12-24/h2,4-5,8-10,13-14,16H,3,6-7,11-12,15H2,1H3