4-[(E)-2-[(3-methoxyphenyl)sulfanylmethyl]-3-(quinolin-3-ylamino)prop-1-enyl]-N-oxidanyl-benzamide

Systemtic Name: 4-[(E)-2-[(3-methoxyphenyl)sulfanylmethyl]-3-(quinolin-3-ylamino)prop-1-enyl]-N-oxidanyl-benzamide Openeye Name: 4-[(E)-2-[(3-methoxyphenyl)sulfanylmethyl]-3-(3-quinolylamino)prop-1-enyl]benzenecarbohydroxamic acid CAS Name: N-hydroxy-4-[(E)-2-[[(3-methoxyphenyl)thio]methyl]-3-(3-quinolinylamino)prop-1-enyl]benzamide IUPAC Name: N-hydroxy-4-[(E)-2-[(3-methoxyphenyl)sulfanylmethyl]-3-(quinolin-3-ylamino)prop-1-enyl]benzamide Traditional Name: 4-[(E)-2-[[(3-methoxyphenyl)thio]methyl]-3-(3-quinolylamino)prop-1-enyl]benzenecarbohydroxamic acid Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC(=CC2=CC=C(C=C2)C(=O)NO)CNC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

COC1=CC(=CC=C1)SC/C(=C/C2=CC=C(C=C2)C(=O)NO)/CNC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C27H25N3O3S/c1-33-24-6-4-7-25(15-24)34-18-20(13-19-9-11-21(12-10-19)27(31)30-32)16-28-23-14-22-5-2-3-8-26(22)29-17-23/h2-15,17,28,32H,16,18H2,1H3,(H,30,31)/b20-13+