N-[2-(naphthalen-2-ylmethylamino)ethyl]-2-(pyridin-2-ylmethylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-(naphthalen-2-ylmethylamino)ethyl]-2-(pyridin-2-ylmethylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-(2-naphthylmethylamino)ethyl]-2-(2-pyridylmethylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-(2-naphthalenylmethylamino)ethyl]-2-(2-pyridinylmethylamino)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-(naphthalen-2-ylmethylamino)ethyl]-2-(pyridin-2-ylmethylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-(2-naphthylmethylamino)ethyl]-2-(2-pyridylmethylamino)-1,3-benzothiazole-6-carboxamide Formula: C27H25N5OS MolecularWeight: 467.5853

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CNCCNC(=O)C3=CC4=C(C=C3)N=C(S4)NCC5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CNCCNC(=O)C3=CC4=C(C=C3)N=C(S4)NCC5=CC=CC=N5

InChI

InChI=1S/C27H25N5OS/c33-26(30-14-13-28-17-19-8-9-20-5-1-2-6-21(20)15-19)22-10-11-24-25(16-22)34-27(32-24)31-18-23-7-3-4-12-29-23/h1-12,15-16,28H,13-14,17-18H2,(H,30,33)(H,31,32)