N-[6-[3-(naphthalen-2-ylmethylamino)piperidin-1-yl]carbonyl-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[6-[3-(naphthalen-2-ylmethylamino)piperidin-1-yl]carbonyl-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[6-[3-(2-naphthylmethylamino)piperidine-1-carbonyl]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[6-[[3-(2-naphthalenylmethylamino)-1-piperidinyl]-oxomethyl]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[6-[3-(naphthalen-2-ylmethylamino)piperidine-1-carbonyl]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[6-[3-(2-naphthylmethylamino)piperidine-1-carbonyl]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C31H34N4O2S MolecularWeight: 526.69226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCCC(C4)NCC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)N4CCCC(C4)NCC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C31H34N4O2S/c36-29(23-8-2-1-3-9-23)34-31-33-27-15-14-25(18-28(27)38-31)30(37)35-16-6-11-26(20-35)32-19-21-12-13-22-7-4-5-10-24(22)17-21/h4-5,7,10,12-15,17-18,23,26,32H,1-3,6,8-9,11,16,19-20H2,(H,33,34,36)