(2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propanamide

Systemtic Name: (2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propanamide Openeye Name: (2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propanamide CAS Name: (2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propanamide IUPAC Name: (2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propanamide Traditional Name: (2R)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(4-cyanophenyl)propionamide Formula: C19H18N4OS MolecularWeight: 350.43742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C#N)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H18N4OS/c1-13(19(24)21-15-9-7-14(11-20)8-10-15)23(2)12-18-22-16-5-3-4-6-17(16)25-18/h3-10,13H,12H2,1-2H3,(H,21,24)/t13-/m1/s1