N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enamide

Systemtic Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enamide Openeye Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-indolin-1-ylsulfonyl-4,5-dimethoxy-phenyl)prop-2-enamide CAS Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]-2-propenamide IUPAC Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enamide Traditional Name: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-(3-indolin-1-ylsulfonyl-4,5-dimethoxy-phenyl)acrylamide Formula: C29H29N3O5S2 MolecularWeight: 563.68766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)NC2=C(C3=C(S2)CCCCC3)C#N)S(=O)(=O)N4CCC5=CC=CC=C54)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=CC(=O)NC2=C(C3=C(S2)CCCCC3)C#N)S(=O)(=O)N4CCC5=CC=CC=C54)OC

InChI

InChI=1S/C29H29N3O5S2/c1-36-24-16-19(12-13-27(33)31-29-22(18-30)21-9-4-3-5-11-25(21)38-29)17-26(28(24)37-2)39(34,35)32-15-14-20-8-6-7-10-23(20)32/h6-8,10,12-13,16-17H,3-5,9,11,14-15H2,1-2H3,(H,31,33)