3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(prop-2-enylamino)butan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(prop-2-enylamino)butan-2-yl]benzamide Openeye Name: N-[1-(allylcarbamoyl)-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-(methylthio)-1-oxo-1-(prop-2-enylamino)butan-2-yl]benzamide IUPAC Name: 3-methyl-N-[4-methylsulfanyl-1-oxo-1-(prop-2-enylamino)butan-2-yl]benzamide Traditional Name: N-[1-(allylcarbamoyl)-3-(methylthio)propyl]-3-methyl-benzamide Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)NCC=C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)NCC=C

InChI

InChI=1S/C16H22N2O2S/c1-4-9-17-16(20)14(8-10-21-3)18-15(19)13-7-5-6-12(2)11-13/h4-7,11,14H,1,8-10H2,2-3H3,(H,17,20)(H,18,19)