4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-3-methyl-benzoate

Systemtic Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-3-methyl-benzoate Openeye Name: 4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-3-methylbenzoate IUPAC Name: 4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]-3-methyl-benzoate Formula: C17H13N2O3S2- MolecularWeight: 357.42672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H14N2O3S2/c1-10-8-11(16(21)22)6-7-12(10)18-15(20)9-23-17-19-13-4-2-3-5-14(13)24-17/h2-8H,9H2,1H3,(H,18,20)(H,21,22)/p-1