3-acetamido-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[4-(3-methylpiperidino)sulfonylphenyl]-3-(2-thienyl)propionamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC(C3=CC=CS3)NC(=O)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC(C3=CC=CS3)NC(=O)C

InChI

InChI=1S/C21H27N3O4S2/c1-15-5-3-11-24(14-15)30(27,28)18-9-7-17(8-10-18)23-21(26)13-19(22-16(2)25)20-6-4-12-29-20/h4,6-10,12,15,19H,3,5,11,13-14H2,1-2H3,(H,22,25)(H,23,26)