2-[(3,3-dimethylcyclohexyl)methylcarbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-[(3,3-dimethylcyclohexyl)methylcarbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(3,3-dimethylcyclohexyl)methylcarbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[[(3,3-dimethylcyclohexyl)methylamino]-oxomethyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(3,3-dimethylcyclohexyl)methylcarbamoylamino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(3,3-dimethylcyclohexyl)methylcarbamoylamino]-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCC4CCCC(C4)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCC4CCCC(C4)(C)C)C

InChI

InChI=1S/C27H34N4O2S/c1-16-11-17(2)23(18(3)12-16)30-24(32)20-8-9-21-22(13-20)34-26(29-21)31-25(33)28-15-19-7-6-10-27(4,5)14-19/h8-9,11-13,19H,6-7,10,14-15H2,1-5H3,(H,30,32)(H2,28,29,31,33)