N-[6-[(2,6-dimethylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[6-[(2,6-dimethylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[6-[(2,6-dimethylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[6-[[(2,6-dimethylanilino)-oxomethyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[6-[(2,6-dimethylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[6-[(2,6-dimethylphenyl)carbamoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

InChI

InChI=1S/C23H26N4O2S/c1-14-7-6-8-15(2)20(14)26-22(29)24-17-11-12-18-19(13-17)30-23(25-18)27-21(28)16-9-4-3-5-10-16/h6-8,11-13,16H,3-5,9-10H2,1-2H3,(H2,24,26,29)(H,25,27,28)