N'-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]-3-piperidin-1-ylsulfonyl-benzohydrazide

Systemtic Name: N'-[[2-(4-ethoxyphenyl)-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]methyl]-3-piperidin-1-ylsulfonyl-benzohydrazide Openeye Name: N'-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolylidene]methyl]-3-(1-piperidylsulfonyl)benzohydrazide CAS Name: N'-[[2-(4-ethoxyphenyl)-1,3-dioxo-4-isoquinolinylidene]methyl]-3-(1-piperidinylsulfonyl)benzohydrazide IUPAC Name: N'-[[2-(4-ethoxyphenyl)-1,3-dioxoisoquinolin-4-ylidene]methyl]-3-piperidin-1-ylsulfonylbenzohydrazide Traditional Name: N'-[(1,3-diketo-2-p-phenetyl-4-isoquinolylidene)methyl]-3-piperidinosulfonyl-benzohydrazide Formula: C30H30N4O6S MolecularWeight: 574.6474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCCC5)C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNNC(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCCC5)C2=O

InChI

InChI=1S/C30H30N4O6S/c1-2-40-23-15-13-22(14-16-23)34-29(36)26-12-5-4-11-25(26)27(30(34)37)20-31-32-28(35)21-9-8-10-24(19-21)41(38,39)33-17-6-3-7-18-33/h4-5,8-16,19-20,31H,2-3,6-7,17-18H2,1H3,(H,32,35)