5-bromanyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)thiophene-2-carboxamide hydrochloride

Systemtic Name: 5-bromanyl-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)thiophene-2-carboxamide hydrochloride Openeye Name: 5-bromo-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)thiophene-2-carboxamide hydrochloride CAS Name: 5-bromo-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]-2-thiophenecarboxamide hydrochloride IUPAC Name: 5-bromo-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)thiophene-2-carboxamide hydrochloride Traditional Name: 5-bromo-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)thiophene-2-carboxamide hydrochloride Formula: C20H20BrClN4OS2 MolecularWeight: 511.886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(S4)Br)C.Cl

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N(CCCN3C=CN=C3)C(=O)C4=CC=C(S4)Br)C.Cl

InChI

InChI=1S/C20H19BrN4OS2.ClH/c1-13-4-5-15-18(14(13)2)23-20(28-15)25(10-3-9-24-11-8-22-12-24)19(26)16-6-7-17(21)27-16;/h4-8,11-12H,3,9-10H2,1-2H3;1H