N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-4-[[(phenylmethyl)amino]methyl]benzamide hydrochloride

Systemtic Name: N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-4-[[(phenylmethyl)amino]methyl]benzamide hydrochloride Openeye Name: 4-[(benzylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride CAS Name: N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-4-[[(phenylmethyl)amino]methyl]benzamide hydrochloride IUPAC Name: 4-[(benzylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Traditional Name: 4-[(benzylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide hydrochloride Formula: C29H26ClN3O2S MolecularWeight: 516.05364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNCC5=CC=CC=C5.Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNCC5=CC=CC=C5.Cl

InChI

InChI=1S/C29H25N3O2S.ClH/c1-34-25-17-16-24(22-10-6-3-7-11-22)27-26(25)31-29(35-27)32-28(33)23-14-12-21(13-15-23)19-30-18-20-8-4-2-5-9-20;/h2-17,30H,18-19H2,1H3,(H,31,32,33);1H