N-[4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-methyl-5-(1-piperidylsulfonyl)anilino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-(2-methyl-5-piperidin-1-ylsulfonylanilino)-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-(2-methyl-5-piperidinosulfonyl-anilino)butyl]thiophene-2-carboxamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S2/c1-16-9-10-17(30(27,28)24-12-3-2-4-13-24)15-18(16)23-20(25)8-5-11-22-21(26)19-7-6-14-29-19/h6-7,9-10,14-15H,2-5,8,11-13H2,1H3,(H,22,26)(H,23,25)