2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]ethyl 3,4,5-triethoxybenzoate

Systemtic Name: 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]ethyl 3,4,5-triethoxybenzoate Openeye Name: 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid 2-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid 2-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethyl ester Formula: C28H31N3O6S MolecularWeight: 537.62724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCNC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCCNC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O6S/c1-5-34-22-15-19(16-23(35-6-2)25(22)36-7-3)28(33)37-14-13-29-26(32)24-17-21-18(4)30-31(27(21)38-24)20-11-9-8-10-12-20/h8-12,15-17H,5-7,13-14H2,1-4H3,(H,29,32)