2-(butylaminomethyl)-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

Systemtic Name: 2-(butylaminomethyl)-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Openeye Name: 2-(butylaminomethyl)-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)pyridine-4-carboxamide CAS Name: 2-(butylaminomethyl)-N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-4-pyridinecarboxamide IUPAC Name: 2-(butylaminomethyl)-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Traditional Name: 2-(butylaminomethyl)-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)isonicotinamide Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

Isomeric SMILES

CCCCNCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

InChI

InChI=1S/C23H29N5O3S/c1-3-4-8-24-15-17-14-16(7-9-25-17)22(29)27-23-26-20-19(30-2)6-5-18(21(20)32-23)28-10-12-31-13-11-28/h5-7,9,14,24H,3-4,8,10-13,15H2,1-2H3,(H,26,27,29)