N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide hydrochloride

Systemtic Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-quinoline-4-carboxamide hydrochloride Openeye Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(2-thienyl)quinoline-4-carboxamide hydrochloride CAS Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-4-quinolinecarboxamide hydrochloride IUPAC Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-thiophen-2-ylquinoline-4-carboxamide hydrochloride Traditional Name: N-(2-dimethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-2-(2-thienyl)cinchoninamide hydrochloride Formula: C27H27ClN4OS2 MolecularWeight: 523.11248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C.Cl

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C.Cl

InChI

InChI=1S/C27H26N4OS2.ClH/c1-17-14-18(2)25-23(15-17)29-27(34-25)31(12-11-30(3)4)26(32)20-16-22(24-10-7-13-33-24)28-21-9-6-5-8-19(20)21;/h5-10,13-16H,11-12H2,1-4H3;1H