N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-(thiophen-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(4-azanyl-5-chloranyl-2-methoxy-phenyl)-1-(thiophen-3-ylmethyl)piperidine-4-carboxamide Openeye Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-(3-thienylmethyl)piperidine-4-carboxamide CAS Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-(3-thiophenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-(4-amino-5-chloro-2-methoxyphenyl)-1-(thiophen-3-ylmethyl)piperidine-4-carboxamide Traditional Name: N-(4-amino-5-chloro-2-methoxy-phenyl)-1-(3-thenyl)isonipecotamide Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3=CSC=C3

Isomeric SMILES

COC1=C(C=C(C(=C1)N)Cl)NC(=O)C2CCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C18H22ClN3O2S/c1-24-17-9-15(20)14(19)8-16(17)21-18(23)13-2-5-22(6-3-13)10-12-4-7-25-11-12/h4,7-9,11,13H,2-3,5-6,10,20H2,1H3,(H,21,23)