N-[1-[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[(E)-3-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)prop-2-enoyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)-1-oxoprop-2-enyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[(E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-[(E)-3-(3-chloro-4-ethoxy-5-methoxy-phenyl)acryloyl]-4-piperidyl]thiophene-2-sulfonamide Formula: C21H25ClN2O5S2 MolecularWeight: 485.0166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=CC(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)/C=C/C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C21H25ClN2O5S2/c1-3-29-21-17(22)13-15(14-18(21)28-2)6-7-19(25)24-10-8-16(9-11-24)23-31(26,27)20-5-4-12-30-20/h4-7,12-14,16,23H,3,8-11H2,1-2H3/b7-6+