N-[2-(cyclopentylcarbonylamino)-1,3-benzothiazol-6-yl]-4-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide

Systemtic Name: N-[2-(cyclopentylcarbonylamino)-1,3-benzothiazol-6-yl]-4-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide Openeye Name: N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-4-(2-naphthylmethylamino)cyclohexanecarboxamide CAS Name: N-[2-[[cyclopentyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-4-(2-naphthalenylmethylamino)-1-cyclohexanecarboxamide IUPAC Name: N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-4-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide Traditional Name: N-[2-(cyclopentanecarbonylamino)-1,3-benzothiazol-6-yl]-4-(2-naphthylmethylamino)cyclohexanecarboxamide Formula: C31H34N4O2S MolecularWeight: 526.69226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCC(CC4)NCC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCC(CC4)NCC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C31H34N4O2S/c36-29(23-11-13-25(14-12-23)32-19-20-9-10-21-5-1-4-8-24(21)17-20)33-26-15-16-27-28(18-26)38-31(34-27)35-30(37)22-6-2-3-7-22/h1,4-5,8-10,15-18,22-23,25,32H,2-3,6-7,11-14,19H2,(H,33,36)(H,34,35,37)