butyl 2-[(3,4-dimethoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[(3,4-dimethoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[(3,4-dimethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[(3,4-dimethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(veratroylamino)-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O5S/c1-4-5-10-28-20(25)14-6-8-15-18(12-14)29-21(22-15)23-19(24)13-7-9-16(26-2)17(11-13)27-3/h6-9,11-12H,4-5,10H2,1-3H3,(H,22,23,24)