[6-[(5-acetamido-2,4-dimethyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid

Systemtic Name: [6-[(5-acetamido-2,4-dimethyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Openeye Name: [6-[(5-acetamido-2,4-dimethyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid CAS Name: [6-[(5-acetamido-2,4-dimethylanilino)-oxomethyl]-1,3-benzothiazol-2-yl]carbamic acid IUPAC Name: [6-[(5-acetamido-2,4-dimethylphenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Traditional Name: [6-[(5-acetamido-2,4-dimethyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)O)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)O)NC(=O)C)C

InChI

InChI=1S/C19H18N4O4S/c1-9-6-10(2)15(8-14(9)20-11(3)24)21-17(25)12-4-5-13-16(7-12)28-18(22-13)23-19(26)27/h4-8H,1-3H3,(H,20,24)(H,21,25)(H,22,23)(H,26,27)