4-(1,3-benzothiazol-2-yl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[(6-morpholino-3-pyridyl)methyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[(6-morpholino-3-pyridyl)methyl]butyramide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)CNC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)CNC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N4O2S/c26-20(6-3-7-21-24-17-4-1-2-5-18(17)28-21)23-15-16-8-9-19(22-14-16)25-10-12-27-13-11-25/h1-2,4-5,8-9,14H,3,6-7,10-13,15H2,(H,23,26)