N-(2-diethylaminoethyl)-4-[ethyl-(phenylmethyl)sulfamoyl]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[ethyl-(phenylmethyl)sulfamoyl]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[benzyl(ethyl)sulfamoyl]-N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-4-[ethyl-(phenylmethyl)sulfamoyl]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-[benzyl(ethyl)sulfamoyl]-N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[benzyl(ethyl)sulfamoyl]-N-(2-diethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C30H36N4O3S3 MolecularWeight: 596.82684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC)CC4=CC=CC=C4

InChI

InChI=1S/C30H36N4O3S3/c1-5-32(6-2)19-20-34(30-31-27-18-15-25(38-4)21-28(27)39-30)29(35)24-13-16-26(17-14-24)40(36,37)33(7-3)22-23-11-9-8-10-12-23/h8-18,21H,5-7,19-20,22H2,1-4H3