N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]propyl]-1-benzothiophene-3-carboxamide

Systemtic Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]propyl]-1-benzothiophene-3-carboxamide Openeye Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]propyl]benzothiophene-3-carboxamide CAS Name: N-[3-[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]propyl]-1-benzothiophene-3-carboxamide IUPAC Name: N-[3-[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]propyl]-1-benzothiophene-3-carboxamide Traditional Name: N-[3-[4-[3-(isobutyrylamino)phenyl]piperidino]propyl]benzothiophene-3-carboxamide Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCNC(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCCNC(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C27H33N3O2S/c1-19(2)26(31)29-22-8-5-7-21(17-22)20-11-15-30(16-12-20)14-6-13-28-27(32)24-18-33-25-10-4-3-9-23(24)25/h3-5,7-10,17-20H,6,11-16H2,1-2H3,(H,28,32)(H,29,31)