2-[3-(dipropylamino)propoxy]-N-[4-[2-[2-(hydroxymethyl)phenyl]carbonylhydrazinyl]-3-[(1-methylpyridin-1-ium-3-yl)methylsulfanyl]phenyl]ethanamide

Systemtic Name: 2-[3-(dipropylamino)propoxy]-N-[4-[2-[2-(hydroxymethyl)phenyl]carbonylhydrazinyl]-3-[(1-methylpyridin-1-ium-3-yl)methylsulfanyl]phenyl]ethanamide Openeye Name: 2-[3-(dipropylamino)propoxy]-N-[4-[2-[2-(hydroxymethyl)benzoyl]hydrazino]-3-[(1-methylpyridin-1-ium-3-yl)methylsulfanyl]phenyl]acetamide CAS Name: 2-[3-(dipropylamino)propoxy]-N-[4-[[[2-(hydroxymethyl)phenyl]-oxomethyl]hydrazo]-3-[(1-methyl-3-pyridin-1-iumyl)methylthio]phenyl]acetamide IUPAC Name: 2-[3-(dipropylamino)propoxy]-N-[4-[2-[2-(hydroxymethyl)benzoyl]hydrazinyl]-3-[(1-methylpyridin-1-ium-3-yl)methylsulfanyl]phenyl]acetamide Traditional Name: 2-[3-(dipropylamino)propoxy]-N-[4-[N'-(2-methylolbenzoyl)hydrazino]-3-[(1-methylpyridin-1-ium-3-yl)methylthio]phenyl]acetamide Formula: C32H44N5O4S+ MolecularWeight: 594.78786

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCOCC(=O)NC1=CC(=C(C=C1)NNC(=O)C2=CC=CC=C2CO)SCC3=C[N+](=CC=C3)C

Isomeric SMILES

CCCN(CCC)CCCOCC(=O)NC1=CC(=C(C=C1)NNC(=O)C2=CC=CC=C2CO)SCC3=C[N+](=CC=C3)C

InChI

InChI=1S/C32H43N5O4S/c1-4-15-37(16-5-2)18-9-19-41-23-31(39)33-27-13-14-29(30(20-27)42-24-25-10-8-17-36(3)21-25)34-35-32(40)28-12-7-6-11-26(28)22-38/h6-8,10-14,17,20-21,34,38H,4-5,9,15-16,18-19,22-24H2,1-3H3,(H-,33,35,39,40)/p+1