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

Systemtic Name: N-tert-butyl-4-[3-[2-chloranyl-5-[3-(diethylamino)propanoylamino]phenyl]-5-ethoxy-3-methyl-2-oxidanylidene-indol-1-yl]sulfonyl-2-methoxy-benzamide Openeye Name: N-tert-butyl-4-[3-[2-chloro-5-[3-(diethylamino)propanoylamino]phenyl]-5-ethoxy-3-methyl-2-oxo-indolin-1-yl]sulfonyl-2-methoxy-benzamide CAS Name: N-tert-butyl-4-[[3-[2-chloro-5-[[3-(diethylamino)-1-oxopropyl]amino]phenyl]-5-ethoxy-3-methyl-2-oxo-1-indolyl]sulfonyl]-2-methoxybenzamide IUPAC Name: N-tert-butyl-4-[3-[2-chloro-5-[3-(diethylamino)propanoylamino]phenyl]-5-ethoxy-3-methyl-2-oxoindol-1-yl]sulfonyl-2-methoxybenzamide Traditional Name: N-tert-butyl-4-[3-[2-chloro-5-[3-(diethylamino)propanoylamino]phenyl]-5-ethoxy-2-keto-3-methyl-indolin-1-yl]sulfonyl-2-methoxy-benzamide Formula: C36H45ClN4O7S MolecularWeight: 713.2831

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)NC1=CC(=C(C=C1)Cl)C2(C3=C(C=CC(=C3)OCC)N(C2=O)S(=O)(=O)C4=CC(=C(C=C4)C(=O)NC(C)(C)C)OC)C

Isomeric SMILES

CCN(CC)CCC(=O)NC1=CC(=C(C=C1)Cl)C2(C3=C(C=CC(=C3)OCC)N(C2=O)S(=O)(=O)C4=CC(=C(C=C4)C(=O)NC(C)(C)C)OC)C

InChI

InChI=1S/C36H45ClN4O7S/c1-9-40(10-2)19-18-32(42)38-23-12-16-29(37)27(20-23)36(7)28-21-24(48-11-3)13-17-30(28)41(34(36)44)49(45,46)25-14-15-26(31(22-25)47-8)33(43)39-35(4,5)6/h12-17,20-22H,9-11,18-19H2,1-8H3,(H,38,42)(H,39,43)