N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-1,2,5-trimethyl-pyrrole-3-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-1,2,5-trimethyl-pyrrole-3-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-1,2,5-trimethyl-pyrrole-3-carboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-1,2,5-trimethyl-3-pyrrolecarboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-1,2,5-trimethylpyrrole-3-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-1,2,5-trimethyl-pyrrole-3-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

InChI

InChI=1S/C22H26N4O2S/c1-13-11-17(14(2)26(13)3)21(28)23-16-9-10-18-19(12-16)29-22(24-18)25-20(27)15-7-5-4-6-8-15/h9-12,15H,4-8H2,1-3H3,(H,23,28)(H,24,25,27)