N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1=C(C=CS1)S(=O)(=O)N2CCCCC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)C1=C(C=CS1)S(=O)(=O)N2CCCCC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C21H29N3O3S2/c1-3-23(18-9-7-8-17(2)16-18)14-11-22-21(25)20-19(10-15-28-20)29(26,27)24-12-5-4-6-13-24/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,22,25)