N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-4-propan-2-ylsulfanyl-benzamide hydrochloride

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-4-propan-2-ylsulfanyl-benzamide hydrochloride Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-4-isopropylsulfanyl-benzamide hydrochloride CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]-4-(propan-2-ylthio)benzamide hydrochloride IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-4-propan-2-ylsulfanylbenzamide hydrochloride Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-4-(isopropylthio)benzamide hydrochloride Formula: C24H26Cl2N4OS2 MolecularWeight: 521.52544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(C=C4)SC(C)C)Cl.Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(C=C4)SC(C)C)Cl.Cl

InChI

InChI=1S/C24H25ClN4OS2.ClH/c1-16(2)31-19-7-5-18(6-8-19)23(30)29(13-4-12-28-14-11-26-15-28)24-27-22-17(3)20(25)9-10-21(22)32-24;/h5-11,14-16H,4,12-13H2,1-3H3;1H