1-[(3-chloranyl-4-methyl-1-benzothiophen-2-yl)carbonyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-chloranyl-4-methyl-1-benzothiophen-2-yl)carbonyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(3-chloro-4-methyl-benzothiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: 1-[(3-chloro-4-methyl-1-benzothiophen-2-yl)-oxomethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(3-chloro-4-methyl-1-benzothiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(3-chloro-4-methyl-benzothiophene-2-carbonyl)isonipecotamide Formula: C23H23ClN2O2S MolecularWeight: 426.95892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=C2Cl)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H23ClN2O2S/c1-15-6-5-9-18-19(15)20(24)21(29-18)23(28)26-12-10-17(11-13-26)22(27)25-14-16-7-3-2-4-8-16/h2-9,17H,10-14H2,1H3,(H,25,27)