N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C21H23N3O3S2/c1-16-7-8-17(29(26,27)24-12-3-2-4-13-24)15-18(16)22-21(25)20-19(9-14-28-20)23-10-5-6-11-23/h5-11,14-15H,2-4,12-13H2,1H3,(H,22,25)