N-tert-butyl-4-[3-[2-chloranyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-ethoxy-3-methyl-2-oxidanylidene-indol-1-yl]sulfonyl-2-methoxy-benzamide

Systemtic Name: N-tert-butyl-4-[3-[2-chloranyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-ethoxy-3-methyl-2-oxidanylidene-indol-1-yl]sulfonyl-2-methoxy-benzamide Openeye Name: N-tert-butyl-4-[3-[2-chloro-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-ethoxy-3-methyl-2-oxo-indolin-1-yl]sulfonyl-2-methoxy-benzamide CAS Name: N-tert-butyl-4-[[3-[2-chloro-5-[(4-methyl-1-piperazinyl)methyl]phenyl]-5-ethoxy-3-methyl-2-oxo-1-indolyl]sulfonyl]-2-methoxybenzamide IUPAC Name: N-tert-butyl-4-[3-[2-chloro-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-ethoxy-3-methyl-2-oxoindol-1-yl]sulfonyl-2-methoxybenzamide Traditional Name: N-tert-butyl-4-[3-[2-chloro-5-[(4-methylpiperazino)methyl]phenyl]-5-ethoxy-2-keto-3-methyl-indolin-1-yl]sulfonyl-2-methoxy-benzamide Formula: C35H43ClN4O6S MolecularWeight: 683.25712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)C2(C)C3=C(C=CC(=C3)CN4CCN(CC4)C)Cl)S(=O)(=O)C5=CC(=C(C=C5)C(=O)NC(C)(C)C)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)C2(C)C3=C(C=CC(=C3)CN4CCN(CC4)C)Cl)S(=O)(=O)C5=CC(=C(C=C5)C(=O)NC(C)(C)C)OC

InChI

InChI=1S/C35H43ClN4O6S/c1-8-46-24-10-14-30-28(20-24)35(5,27-19-23(9-13-29(27)36)22-39-17-15-38(6)16-18-39)33(42)40(30)47(43,44)25-11-12-26(31(21-25)45-7)32(41)37-34(2,3)4/h9-14,19-21H,8,15-18,22H2,1-7H3,(H,37,41)