N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethanamide Openeye Name: 2-[allyl(2-thienylmethyl)amino]-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]acetamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]acetamide Traditional Name: 2-[allyl(2-thenyl)amino]-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)acetamide Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(CC=C)CC2=CC=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(CC=C)CC2=CC=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H31N3O4S2/c1-3-12-25(17-20-9-8-15-31-20)18-23(27)24-19-10-11-21(30-4-2)22(16-19)32(28,29)26-13-6-5-7-14-26/h3,8-11,15-16H,1,4-7,12-14,17-18H2,2H3,(H,24,27)