methyl 4-methyl-5-[[4-[(2-piperazin-1-ylphenyl)carbamoyl]-1,3-thiazol-2-yl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 4-methyl-5-[[4-[(2-piperazin-1-ylphenyl)carbamoyl]-1,3-thiazol-2-yl]amino]thiophene-2-carboxylate Openeye Name: methyl 4-methyl-5-[[4-[(2-piperazin-1-ylphenyl)carbamoyl]thiazol-2-yl]amino]thiophene-2-carboxylate CAS Name: 4-methyl-5-[[4-[oxo-[2-(1-piperazinyl)anilino]methyl]-2-thiazolyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-[[4-[(2-piperazin-1-ylphenyl)carbamoyl]-1,3-thiazol-2-yl]amino]thiophene-2-carboxylate Traditional Name: 4-methyl-5-[[4-[(2-piperazinophenyl)carbamoyl]thiazol-2-yl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H23N5O3S2 MolecularWeight: 457.56902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)OC)NC2=NC(=CS2)C(=O)NC3=CC=CC=C3N4CCNCC4

Isomeric SMILES

CC1=C(SC(=C1)C(=O)OC)NC2=NC(=CS2)C(=O)NC3=CC=CC=C3N4CCNCC4

InChI

InChI=1S/C21H23N5O3S2/c1-13-11-17(20(28)29-2)31-19(13)25-21-24-15(12-30-21)18(27)23-14-5-3-4-6-16(14)26-9-7-22-8-10-26/h3-6,11-12,22H,7-10H2,1-2H3,(H,23,27)(H,24,25)