4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[(4-methoxyphenyl)methyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-p-anisyl-butyramide Formula: C19H20N2O2S2 MolecularWeight: 372.5043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N2O2S2/c1-23-15-10-8-14(9-11-15)13-20-18(22)7-4-12-24-19-21-16-5-2-3-6-17(16)25-19/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,20,22)