methyl 4-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-morpholin-4-ylethyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-morpholin-4-ylethyl)carbamoyl]benzoate Openeye Name: methyl 4-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-morpholinoethyl)carbamoyl]benzoate CAS Name: 4-[[(5-methoxy-1,3-benzothiazol-2-yl)-[2-(4-morpholinyl)ethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-morpholin-4-ylethyl)carbamoyl]benzoate Traditional Name: 4-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-morpholinoethyl)carbamoyl]benzoic acid methyl ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H25N3O5S/c1-29-18-7-8-20-19(15-18)24-23(32-20)26(10-9-25-11-13-31-14-12-25)21(27)16-3-5-17(6-4-16)22(28)30-2/h3-8,15H,9-14H2,1-2H3