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

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]ethanamide Openeye Name: 2-[allyl(2-thienylsulfonyl)amino]-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetamide Traditional Name: 2-[allyl(2-thienylsulfonyl)amino]-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C21H27N3O5S3 MolecularWeight: 497.65118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(CC=C)S(=O)(=O)C2=CC=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(CC=C)S(=O)(=O)C2=CC=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O5S3/c1-3-11-24(32(28,29)21-8-7-14-30-21)16-20(25)22-18-10-9-17(2)19(15-18)31(26,27)23-12-5-4-6-13-23/h3,7-10,14-15H,1,4-6,11-13,16H2,2H3,(H,22,25)