4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride

Systemtic Name: 4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Openeye Name: 4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride CAS Name: 4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]benzamide hydrochloride IUPAC Name: 4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Traditional Name: 4-butoxy-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)benzamide hydrochloride Formula: C26H31ClN4O2S MolecularWeight: 499.06794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CCCN2C=CN=C2)C3=NC4=C(S3)C=CC(=C4C)C.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CCCN2C=CN=C2)C3=NC4=C(S3)C=CC(=C4C)C.Cl

InChI

InChI=1S/C26H30N4O2S.ClH/c1-4-5-17-32-22-10-8-21(9-11-22)25(31)30(15-6-14-29-16-13-27-18-29)26-28-24-20(3)19(2)7-12-23(24)33-26;/h7-13,16,18H,4-6,14-15,17H2,1-3H3;1H