4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide CAS Name: 4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 4-butoxy-N-(4-ethoxy-1,3-benzothiazol-2-yl)-N-(3-morpholinopropyl)benzamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)OCC

InChI

InChI=1S/C27H35N3O4S/c1-3-5-18-34-22-12-10-21(11-13-22)26(31)30(15-7-14-29-16-19-32-20-17-29)27-28-25-23(33-4-2)8-6-9-24(25)35-27/h6,8-13H,3-5,7,14-20H2,1-2H3