2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-(2-chloranyl-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-(2-chloranyl-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C23H17ClN4O4S MolecularWeight: 480.92348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H17ClN4O4S/c1-12-3-2-4-15(24)20(12)27-21(29)13-5-7-16-19(9-13)33-23(26-16)28-22(30)25-14-6-8-17-18(10-14)32-11-31-17/h2-10H,11H2,1H3,(H,27,29)(H2,25,26,28,30)