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

Systemtic Name: 2-(cyclopentylcarbonylamino)-N-[2-(naphthalen-2-ylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclopentanecarbonylamino)-N-[2-(2-naphthylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[cyclopentyl(oxo)methyl]amino]-N-[2-(2-naphthalenylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclopentanecarbonylamino)-N-[2-(naphthalen-2-ylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclopentanecarbonylamino)-N-[2-(2-naphthylmethylamino)ethyl]-1,3-benzothiazole-6-carboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCNCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCNCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H28N4O2S/c32-25(29-14-13-28-17-18-9-10-19-5-1-4-8-21(19)15-18)22-11-12-23-24(16-22)34-27(30-23)31-26(33)20-6-2-3-7-20/h1,4-5,8-12,15-16,20,28H,2-3,6-7,13-14,17H2,(H,29,32)(H,30,31,33)