N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-propan-2-ylsulfanyl-benzamide hydrochloride

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-propan-2-ylsulfanyl-benzamide hydrochloride Openeye Name: N-(3-imidazol-1-ylpropyl)-4-isopropylsulfanyl-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)benzamide hydrochloride CAS Name: N-[3-(1-imidazolyl)propyl]-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-(propan-2-ylthio)benzamide hydrochloride IUPAC Name: N-(3-imidazol-1-ylpropyl)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-4-propan-2-ylsulfanylbenzamide hydrochloride Traditional Name: N-(3-imidazol-1-ylpropyl)-4-(isopropylthio)-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Formula: C25H29ClN4O2S2 MolecularWeight: 517.10636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(C=C4)SC(C)C.Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)OC)N=C(S2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(C=C4)SC(C)C.Cl

InChI

InChI=1S/C25H28N4O2S2.ClH/c1-17(2)32-20-9-7-19(8-10-20)24(30)29(14-5-13-28-15-12-26-16-28)25-27-22-21(31-4)11-6-18(3)23(22)33-25;/h6-12,15-17H,5,13-14H2,1-4H3;1H