N-[3-cyano-4-[4-(2-hydroxyethyl)piperidin-1-yl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperidin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-cyano-4-[4-(2-hydroxyethyl)-1-piperidyl]phenyl]benzothiophene-2-carboxamide CAS Name: N-[3-cyano-4-[4-(2-hydroxyethyl)-1-piperidinyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperidin-1-yl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[3-cyano-4-[4-(2-hydroxyethyl)piperidino]phenyl]benzothiophene-2-carboxamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4S3)C#N

Isomeric SMILES

C1CN(CCC1CCO)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4S3)C#N

InChI

InChI=1S/C23H23N3O2S/c24-15-18-13-19(5-6-20(18)26-10-7-16(8-11-26)9-12-27)25-23(28)22-14-17-3-1-2-4-21(17)29-22/h1-6,13-14,16,27H,7-12H2,(H,25,28)