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

Systemtic Name: [6-[(2,6-dimethyl-4-phenyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Openeye Name: [6-[(2,6-dimethyl-4-phenyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid CAS Name: [6-[(2,6-dimethyl-4-phenylanilino)-oxomethyl]-1,3-benzothiazol-2-yl]carbamic acid IUPAC Name: [6-[(2,6-dimethyl-4-phenylphenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Traditional Name: [6-[(2,6-dimethyl-4-phenyl-phenyl)carbamoyl]-1,3-benzothiazol-2-yl]carbamic acid Formula: C23H19N3O3S MolecularWeight: 417.48026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)O)C)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O3S/c1-13-10-17(15-6-4-3-5-7-15)11-14(2)20(13)25-21(27)16-8-9-18-19(12-16)30-22(24-18)26-23(28)29/h3-12H,1-2H3,(H,24,26)(H,25,27)(H,28,29)