N-butyl-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-butyl-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-butyl-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-butyl-N-(3-pyridinylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-butyl-N-(pyridin-3-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-butyl-N-(3-pyridylmethyl)-1,3-benzothiazole-6-carboxamide Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CN=CC=C1)C(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CCCCN(CC1=CN=CC=C1)C(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C18H19N3OS/c1-2-3-9-21(12-14-5-4-8-19-11-14)18(22)15-6-7-16-17(10-15)23-13-20-16/h4-8,10-11,13H,2-3,9,12H2,1H3