N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]propionamide Formula: C24H31N3O4S3 MolecularWeight: 521.71564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31N3O4S3/c1-5-26(6-2)14-15-27(24-25-21-12-9-19(32-4)17-22(21)33-24)23(28)13-16-34(29,30)20-10-7-18(31-3)8-11-20/h7-12,17H,5-6,13-16H2,1-4H3