2-[(3-methylphenyl)carbamoylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3-methylphenyl)carbamoylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(m-tolylcarbamoylamino)thiazole-4-carboxamide CAS Name: 2-[[(3-methylanilino)-oxomethyl]amino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-[(3-methylphenyl)carbamoylamino]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(m-tolylcarbamoylamino)thiazole-4-carboxamide Formula: C20H17N5O4S3 MolecularWeight: 487.57508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C20H17N5O4S3/c1-11-4-3-5-12(8-11)21-18(27)25-19-23-15(10-30-19)17(26)24-20-22-14-7-6-13(32(2,28)29)9-16(14)31-20/h3-10H,1-2H3,(H,22,24,26)(H2,21,23,25,27)