2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(4-methoxy-3-piperidinosulfonyl-phenyl)acetamide Formula: C22H28ClN3O4S2 MolecularWeight: 498.05842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28ClN3O4S2/c1-3-11-25(15-18-8-10-21(23)31-18)16-22(27)24-17-7-9-19(30-2)20(14-17)32(28,29)26-12-5-4-6-13-26/h3,7-10,14H,1,4-6,11-13,15-16H2,2H3,(H,24,27)