2-(cyclohexylcarbonylamino)-N-[[3-[(naphthalen-2-ylmethylamino)methyl]phenyl]methyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(cyclohexylcarbonylamino)-N-[[3-[(naphthalen-2-ylmethylamino)methyl]phenyl]methyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclohexanecarbonylamino)-N-[[3-[(2-naphthylmethylamino)methyl]phenyl]methyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[cyclohexyl(oxo)methyl]amino]-N-[[3-[(2-naphthalenylmethylamino)methyl]phenyl]methyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclohexanecarbonylamino)-N-[[3-[(naphthalen-2-ylmethylamino)methyl]phenyl]methyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclohexanecarbonylamino)-N-[3-[(2-naphthylmethylamino)methyl]benzyl]-1,3-benzothiazole-6-carboxamide Formula: C34H34N4O2S MolecularWeight: 562.72436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCC4=CC(=CC=C4)CNCC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCC4=CC(=CC=C4)CNCC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C34H34N4O2S/c39-32(29-15-16-30-31(19-29)41-34(37-30)38-33(40)27-10-2-1-3-11-27)36-22-24-8-6-7-23(17-24)20-35-21-25-13-14-26-9-4-5-12-28(26)18-25/h4-9,12-19,27,35H,1-3,10-11,20-22H2,(H,36,39)(H,37,38,40)