N-(2-chloranyl-6-methyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Formula: C25H21ClN4O4S MolecularWeight: 508.97664

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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)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C25H21ClN4O4S/c1-14-5-4-6-17(26)22(14)29-23(31)15-9-10-18-21(11-15)35-25(28-18)30-24(32)27-12-16-13-33-19-7-2-3-8-20(19)34-16/h2-11,16H,12-13H2,1H3,(H,29,31)(H2,27,28,30,32)