N-[4-[6-(cyclohexylcarbonylamino)-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[6-(cyclohexylcarbonylamino)-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[6-(cyclohexanecarbonylamino)-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[6-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[6-(cyclohexanecarbonylamino)-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[6-(cyclohexanecarbonylamino)-1,3-benzothiazol-2-yl]phenyl]cyclohexanecarboxamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)NC(=O)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)NC(=O)C5CCCCC5

InChI

InChI=1S/C27H31N3O2S/c31-25(18-7-3-1-4-8-18)28-21-13-11-20(12-14-21)27-30-23-16-15-22(17-24(23)33-27)29-26(32)19-9-5-2-6-10-19/h11-19H,1-10H2,(H,28,31)(H,29,32)