[2-[(4-bromophenyl)carbamoylamino]-1,3-benzothiazol-6-yl] 2-methylpropanoate

Systemtic Name: [2-[(4-bromophenyl)carbamoylamino]-1,3-benzothiazol-6-yl] 2-methylpropanoate Openeye Name: [2-[(4-bromophenyl)carbamoylamino]-1,3-benzothiazol-6-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[[(4-bromoanilino)-oxomethyl]amino]-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-[(4-bromophenyl)carbamoylamino]-1,3-benzothiazol-6-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[(4-bromophenyl)carbamoylamino]-1,3-benzothiazol-6-yl] ester Formula: C18H16BrN3O3S MolecularWeight: 434.30694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)C(=O)OC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN3O3S/c1-10(2)16(23)25-13-7-8-14-15(9-13)26-18(21-14)22-17(24)20-12-5-3-11(19)4-6-12/h3-10H,1-2H3,(H2,20,21,22,24)