N-[(1R)-1-phenylethyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(1R)-1-phenylethyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(1R)-1-phenylethyl]-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-[(1R)-1-phenylethyl]-N-(3-pyridinylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(1R)-1-phenylethyl]-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-[(1R)-1-phenylethyl]-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CN=CC=C2)C(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(CC2=CN=CC=C2)C(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C22H19N3OS/c1-16(18-7-3-2-4-8-18)25(14-17-6-5-11-23-13-17)22(26)19-9-10-20-21(12-19)27-15-24-20/h2-13,15-16H,14H2,1H3/t16-/m1/s1