methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-(2-piperidin-1-ylethylamino)benzoate

Systemtic Name: methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-(2-piperidin-1-ylethylamino)benzoate Openeye Name: methyl 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-[2-(1-piperidyl)ethylamino]benzoate CAS Name: 5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-2-[2-(1-piperidinyl)ethylamino]benzoic acid methyl ester IUPAC Name: methyl 5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-2-(2-piperidin-1-ylethylamino)benzoate Traditional Name: 5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-2-(2-piperidinoethylamino)benzoic acid methyl ester Formula: C28H35N3O4S MolecularWeight: 509.6602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C=C3)NCCN4CCCCC4)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=C(C=C3)NCCN4CCCCC4)C(=O)OC)OCC

InChI

InChI=1S/C28H35N3O4S/c1-4-34-25-12-10-21(18-26(25)35-5-2)27-30-24(19-36-27)20-9-11-23(22(17-20)28(32)33-3)29-13-16-31-14-7-6-8-15-31/h9-12,17-19,29H,4-8,13-16H2,1-3H3