N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(phenylsulfonyl)propanamide hydrochloride

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-3-(phenylsulfonyl)propanamide hydrochloride Openeye Name: 3-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)propanamide hydrochloride CAS Name: 3-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)propanamide hydrochloride IUPAC Name: 3-(benzenesulfonyl)-N-(1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)propanamide hydrochloride Traditional Name: N-(1,3-benzothiazol-2-yl)-3-besyl-N-(2-diethylaminoethyl)propionamide hydrochloride Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S2.ClH/c1-3-24(4-2)15-16-25(22-23-19-12-8-9-13-20(19)29-22)21(26)14-17-30(27,28)18-10-6-5-7-11-18;/h5-13H,3-4,14-17H2,1-2H3;1H