N-[6-cyano-1-(2-ethoxy-4-methoxy-phenyl)sulfonyl-3-(2-ethoxypyridin-3-yl)-5-fluoranyl-2-oxidanylidene-indol-3-yl]-4-(1-propylpiperidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[6-cyano-1-(2-ethoxy-4-methoxy-phenyl)sulfonyl-3-(2-ethoxypyridin-3-yl)-5-fluoranyl-2-oxidanylidene-indol-3-yl]-4-(1-propylpiperidin-4-yl)piperazine-1-carboxamide Openeye Name: N-[6-cyano-1-(2-ethoxy-4-methoxy-phenyl)sulfonyl-3-(2-ethoxy-3-pyridyl)-5-fluoro-2-oxo-indolin-3-yl]-4-(1-propyl-4-piperidyl)piperazine-1-carboxamide CAS Name: N-[6-cyano-1-(2-ethoxy-4-methoxyphenyl)sulfonyl-3-(2-ethoxy-3-pyridinyl)-5-fluoro-2-oxo-3-indolyl]-4-(1-propyl-4-piperidinyl)-1-piperazinecarboxamide IUPAC Name: N-[6-cyano-1-(2-ethoxy-4-methoxyphenyl)sulfonyl-3-(2-ethoxypyridin-3-yl)-5-fluoro-2-oxoindol-3-yl]-4-(1-propylpiperidin-4-yl)piperazine-1-carboxamide Traditional Name: N-[6-cyano-1-(2-ethoxy-4-methoxy-phenyl)sulfonyl-3-(2-ethoxy-3-pyridyl)-5-fluoro-2-keto-indolin-3-yl]-4-(1-propyl-4-piperidyl)piperazine-1-carboxamide Formula: C38H46FN7O7S MolecularWeight: 763.877943

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)N2CCN(CC2)C(=O)NC3(C4=C(C=C(C(=C4)F)C#N)N(C3=O)S(=O)(=O)C5=C(C=C(C=C5)OC)OCC)C6=C(N=CC=C6)OCC

Isomeric SMILES

CCCN1CCC(CC1)N2CCN(CC2)C(=O)NC3(C4=C(C=C(C(=C4)F)C#N)N(C3=O)S(=O)(=O)C5=C(C=C(C=C5)OC)OCC)C6=C(N=CC=C6)OCC

InChI

InChI=1S/C38H46FN7O7S/c1-5-15-43-16-12-27(13-17-43)44-18-20-45(21-19-44)37(48)42-38(29-9-8-14-41-35(29)53-7-3)30-24-31(39)26(25-40)22-32(30)46(36(38)47)54(49,50)34-11-10-28(51-4)23-33(34)52-6-2/h8-11,14,22-24,27H,5-7,12-13,15-21H2,1-4H3,(H,42,48)