1-(2-ethoxyphenyl)sulfonyl-2-oxidanylidene-3-(4-piperazin-1-ylcarbonylphenoxy)-3-[2-(trifluoromethyloxy)phenyl]indole-5-carbonitrile

Systemtic Name: 1-(2-ethoxyphenyl)sulfonyl-2-oxidanylidene-3-(4-piperazin-1-ylcarbonylphenoxy)-3-[2-(trifluoromethyloxy)phenyl]indole-5-carbonitrile Openeye Name: 1-(2-ethoxyphenyl)sulfonyl-2-oxo-3-[4-(piperazine-1-carbonyl)phenoxy]-3-[2-(trifluoromethoxy)phenyl]indoline-5-carbonitrile CAS Name: 1-(2-ethoxyphenyl)sulfonyl-2-oxo-3-[4-[oxo(1-piperazinyl)methyl]phenoxy]-3-[2-(trifluoromethoxy)phenyl]-5-indolecarbonitrile IUPAC Name: 1-(2-ethoxyphenyl)sulfonyl-2-oxo-3-[4-(piperazine-1-carbonyl)phenoxy]-3-[2-(trifluoromethoxy)phenyl]indole-5-carbonitrile Traditional Name: 2-keto-1-o-phenetylsulfonyl-3-[4-(piperazine-1-carbonyl)phenoxy]-3-[2-(trifluoromethoxy)phenyl]indoline-5-carbonitrile Formula: C35H29F3N4O7S MolecularWeight: 706.68757

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1S(=O)(=O)N2C3=C(C=C(C=C3)C#N)C(C2=O)(C4=CC=CC=C4OC(F)(F)F)OC5=CC=C(C=C5)C(=O)N6CCNCC6

Isomeric SMILES

CCOC1=CC=CC=C1S(=O)(=O)N2C3=C(C=C(C=C3)C#N)C(C2=O)(C4=CC=CC=C4OC(F)(F)F)OC5=CC=C(C=C5)C(=O)N6CCNCC6

InChI

InChI=1S/C35H29F3N4O7S/c1-2-47-30-9-5-6-10-31(30)50(45,46)42-28-16-11-23(22-39)21-27(28)34(33(42)44,26-7-3-4-8-29(26)49-35(36,37)38)48-25-14-12-24(13-15-25)32(43)41-19-17-40-18-20-41/h3-16,21,40H,2,17-20H2,1H3