N-[(E)-1-(4-buta-1,3-dien-2-ylsulfanylphenyl)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(E)-1-(4-buta-1,3-dien-2-ylsulfanylphenyl)-3-(2-hydroxyethylamino)-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-1-(2-hydroxyethylcarbamoyl)-2-[4-(1-methyleneallylsulfanyl)phenyl]vinyl]benzamide CAS Name: N-[(E)-1-[4-(buta-1,3-dien-2-ylthio)phenyl]-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(4-buta-1,3-dien-2-ylsulfanylphenyl)-3-(2-hydroxyethylamino)-3-oxoprop-1-en-2-yl]benzamide Traditional Name: N-[(E)-1-(2-hydroxyethylcarbamoyl)-2-[4-(1-methyleneallylthio)phenyl]vinyl]benzamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=C)SC1=CC=C(C=C1)C=C(C(=O)NCCO)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C=CC(=C)SC1=CC=C(C=C1)/C=C(\C(=O)NCCO)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H22N2O3S/c1-3-16(2)28-19-11-9-17(10-12-19)15-20(22(27)23-13-14-25)24-21(26)18-7-5-4-6-8-18/h3-12,15,25H,1-2,13-14H2,(H,23,27)(H,24,26)/b20-15+