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

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-3-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(2-naphthylmethylamino)cyclohexanecarboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-3-(2-naphthalenylmethylamino)-1-cyclohexanecarboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(naphthalen-2-ylmethylamino)cyclohexane-1-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-3-(2-naphthylmethylamino)cyclohexanecarboxamide Formula: C32H36N4O2S MolecularWeight: 540.71884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCCC(C4)NCC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CCCC(C4)NCC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C32H36N4O2S/c37-30(23-8-2-1-3-9-23)36-32-35-28-16-15-27(19-29(28)39-32)34-31(38)25-11-6-12-26(18-25)33-20-21-13-14-22-7-4-5-10-24(22)17-21/h4-5,7,10,13-17,19,23,25-26,33H,1-3,6,8-9,11-12,18,20H2,(H,34,38)(H,35,36,37)