2-morpholin-4-ylethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: 2-morpholin-4-ylethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 2-morpholinoethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxoprop-1-enyl]benzoic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(1,3-benzothiazol-2-yl)-3-keto-prop-1-enyl]benzoic acid 2-morpholinoethyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC(=O)C2=CC=C(C=C2)C=CC(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1CCOC(=O)C2=CC=C(C=C2)/C=C/C(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H22N2O4S/c26-20(22-24-19-3-1-2-4-21(19)30-22)10-7-17-5-8-18(9-6-17)23(27)29-16-13-25-11-14-28-15-12-25/h1-10H,11-16H2/b10-7+