(3S)-N3-[(5-chloranylthiophen-2-yl)methyl]-N1-phenyl-N3-prop-2-enyl-piperidine-1,3-dicarboxamide

Systemtic Name: (3S)-N3-[(5-chloranylthiophen-2-yl)methyl]-N1-phenyl-N3-prop-2-enyl-piperidine-1,3-dicarboxamide Openeye Name: (3S)-N3-allyl-N3-[(5-chloro-2-thienyl)methyl]-N1-phenyl-piperidine-1,3-dicarboxamide CAS Name: (3S)-N3-[(5-chloro-2-thiophenyl)methyl]-N1-phenyl-N3-prop-2-enylpiperidine-1,3-dicarboxamide IUPAC Name: (3S)-3-N-[(5-chlorothiophen-2-yl)methyl]-1-N-phenyl-3-N-prop-2-enylpiperidine-1,3-dicarboxamide Traditional Name: (3S)-N'-allyl-N'-[(5-chloro-2-thienyl)methyl]-N-phenyl-piperidine-1,3-dicarboxamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)C(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)C(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O2S/c1-2-12-24(15-18-10-11-19(22)28-18)20(26)16-7-6-13-25(14-16)21(27)23-17-8-4-3-5-9-17/h2-5,8-11,16H,1,6-7,12-15H2,(H,23,27)/t16-/m0/s1