N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(phenylsulfonylamino)benzamide hydrochloride

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-4-(phenylsulfonylamino)benzamide hydrochloride Openeye Name: 4-(benzenesulfonamido)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)benzamide hydrochloride CAS Name: 4-(benzenesulfonamido)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)benzamide hydrochloride IUPAC Name: 4-(benzenesulfonamido)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)benzamide hydrochloride Traditional Name: 4-(benzenesulfonamido)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)benzamide hydrochloride Formula: C26H29ClN4O3S2 MolecularWeight: 545.11646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CCN(CC)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H28N4O3S2.ClH/c1-3-29(4-2)18-19-30(26-27-23-12-8-9-13-24(23)34-26)25(31)20-14-16-21(17-15-20)28-35(32,33)22-10-6-5-7-11-22;/h5-17,28H,3-4,18-19H2,1-2H3;1H