N-(1-azanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)-4-(4-octoxyphenyl)benzamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)-4-(4-octoxyphenyl)benzamide Openeye Name: N-[2-amino-2-oxo-1-(sulfanylmethyl)ethyl]-4-(4-octoxyphenyl)benzamide CAS Name: N-(1-amino-3-mercapto-1-oxopropan-2-yl)-4-(4-octoxyphenyl)benzamide IUPAC Name: N-(1-amino-1-oxo-3-sulfanylpropan-2-yl)-4-(4-octoxyphenyl)benzamide Traditional Name: N-[2-amino-2-keto-1-(mercaptomethyl)ethyl]-4-(4-octoxyphenyl)benzamide Formula: C24H32N2O3S MolecularWeight: 428.58748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(CS)C(=O)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(CS)C(=O)N

InChI

InChI=1S/C24H32N2O3S/c1-2-3-4-5-6-7-16-29-21-14-12-19(13-15-21)18-8-10-20(11-9-18)24(28)26-22(17-30)23(25)27/h8-15,22,30H,2-7,16-17H2,1H3,(H2,25,27)(H,26,28)