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

Systemtic Name: 2-(cyclobutylcarbonylamino)-N-[2-(naphthalen-2-ylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclobutanecarbonylamino)-N-[2-(2-naphthylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[cyclobutyl(oxo)methyl]amino]-N-[2-(2-naphthalenylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclobutanecarbonylamino)-N-[2-(naphthalen-2-ylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclobutanecarbonylamino)-N-[2-(2-naphthylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCNCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCNCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H26N4O2S/c31-24(28-13-12-27-16-17-8-9-18-4-1-2-5-20(18)14-17)21-10-11-22-23(15-21)33-26(29-22)30-25(32)19-6-3-7-19/h1-2,4-5,8-11,14-15,19,27H,3,6-7,12-13,16H2,(H,28,31)(H,29,30,32)