ethyl 4-[[4-azanyl-3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-thiazol-5-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[4-azanyl-3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-thiazol-5-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-amino-3-[(4-methoxyphenyl)methylcarbamoyl]isothiazole-5-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-amino-3-[[(4-methoxyphenyl)methylamino]-oxomethyl]-5-isothiazolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-amino-3-[(4-methoxyphenyl)methylcarbamoyl]-1,2-thiazole-5-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-amino-3-(p-anisylcarbamoyl)isothiazole-5-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H25N5O5S MolecularWeight: 447.508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=NS2)C(=O)NCC3=CC=C(C=C3)OC)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C(=NS2)C(=O)NCC3=CC=C(C=C3)OC)N

InChI

InChI=1S/C20H25N5O5S/c1-3-30-20(28)25-10-8-24(9-11-25)19(27)17-15(21)16(23-31-17)18(26)22-12-13-4-6-14(29-2)7-5-13/h4-7H,3,8-12,21H2,1-2H3,(H,22,26)