N-(1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-(2-methylphenyl)-4-[(E)-2-pyridin-3-ylethenyl]benzamide

Systemtic Name: N-(1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-2-(2-methylphenyl)-4-[(E)-2-pyridin-3-ylethenyl]benzamide Openeye Name: N-(1-carbamoyl-3-methylsulfanyl-propyl)-2-(o-tolyl)-4-[(E)-2-(3-pyridyl)vinyl]benzamide CAS Name: N-[1-amino-4-(methylthio)-1-oxobutan-2-yl]-2-(2-methylphenyl)-4-[(E)-2-(3-pyridinyl)ethenyl]benzamide IUPAC Name: N-(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)-2-(2-methylphenyl)-4-[(E)-2-pyridin-3-ylethenyl]benzamide Traditional Name: N-[1-carbamoyl-3-(methylthio)propyl]-2-(o-tolyl)-4-[(E)-2-(3-pyridyl)vinyl]benzamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)C=CC3=CN=CC=C3)C(=O)NC(CCSC)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)/C=C/C3=CN=CC=C3)C(=O)NC(CCSC)C(=O)N

InChI

InChI=1S/C26H27N3O2S/c1-18-6-3-4-8-21(18)23-16-19(9-10-20-7-5-14-28-17-20)11-12-22(23)26(31)29-24(25(27)30)13-15-32-2/h3-12,14,16-17,24H,13,15H2,1-2H3,(H2,27,30)(H,29,31)/b10-9+