N-[4-(diethylaminomethyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(diethylaminomethyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(diethylaminomethyl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(diethylaminomethyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(diethylaminomethyl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(diethylaminomethyl)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H29N3O3S2/c1-3-23(4-2)16-17-7-9-19(10-8-17)22-21(25)18-11-13-24(14-12-18)29(26,27)20-6-5-15-28-20/h5-10,15,18H,3-4,11-14,16H2,1-2H3,(H,22,25)