2-(cyclohexylmethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(cyclohexylmethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(cyclohexylmethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[(cyclohexylmethylamino)-oxomethyl]amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(cyclohexylmethylcarbamoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(cyclohexylmethylcarbamoylamino)-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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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)NCC4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCC4CCCCC4)C

InChI

InChI=1S/C25H30N4O2S/c1-15-11-16(2)22(17(3)12-15)28-23(30)19-9-10-20-21(13-19)32-25(27-20)29-24(31)26-14-18-7-5-4-6-8-18/h9-13,18H,4-8,14H2,1-3H3,(H,28,30)(H2,26,27,29,31)