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

Systemtic Name: 2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[2-[[(3-methylanilino)-oxomethyl]amino]-4-thiazolyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[2-[(3-methylphenyl)carbamoylamino]-1,3-thiazol-4-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[2-(m-tolylcarbamoylamino)thiazol-4-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C20H16N6O4S2 MolecularWeight: 468.50884

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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)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O4S2/c1-11-3-2-4-12(7-11)21-18(28)25-19-22-13(10-31-19)8-17(27)24-20-23-15-6-5-14(26(29)30)9-16(15)32-20/h2-7,9-10H,8H2,1H3,(H,23,24,27)(H2,21,22,25,28)