1-[(4-ethoxyphenyl)carbamothioyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[(4-ethoxyphenyl)carbamothioyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[(4-ethoxyphenyl)carbamothioyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[(4-ethoxyanilino)-sulfanylidenemethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[(4-ethoxyphenyl)carbamothioyl]-N-phenylpiperidine-3-carboxamide Traditional Name: N-phenyl-1-(p-phenetylthiocarbamoyl)nipecotamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2S/c1-2-26-19-12-10-18(11-13-19)23-21(27)24-14-6-7-16(15-24)20(25)22-17-8-4-3-5-9-17/h3-5,8-13,16H,2,6-7,14-15H2,1H3,(H,22,25)(H,23,27)