N-[(2R)-4-phenylbutan-2-yl]-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(2R)-4-phenylbutan-2-yl]-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-N-(2-pyridylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[(2R)-4-phenylbutan-2-yl]-N-(2-pyridinylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(2R)-4-phenylbutan-2-yl]-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-[(1R)-1-methyl-3-phenyl-propyl]-N-(2-pyridylmethyl)-1,3-benzothiazole-6-carboxamide Formula: C24H23N3OS MolecularWeight: 401.52392

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N(CC2=CC=CC=N2)C(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)N(CC2=CC=CC=N2)C(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C24H23N3OS/c1-18(10-11-19-7-3-2-4-8-19)27(16-21-9-5-6-14-25-21)24(28)20-12-13-22-23(15-20)29-17-26-22/h2-9,12-15,17-18H,10-11,16H2,1H3/t18-/m1/s1