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

Systemtic Name: 2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]acetamide CAS Name: 2-[2-[[(3-methylanilino)-oxomethyl]amino]-4-thiazolyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]acetamide Formula: C21H19N5O4S3 MolecularWeight: 501.60166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N5O4S3/c1-12-4-3-5-13(8-12)22-19(28)26-20-23-14(11-31-20)9-18(27)25-21-24-16-7-6-15(33(2,29)30)10-17(16)32-21/h3-8,10-11H,9H2,1-2H3,(H,24,25,27)(H2,22,23,26,28)