4-(5-methylthiophen-2-yl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(5-methylthiophen-2-yl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxidanylidene-butanamide Openeye Name: 4-(5-methyl-2-thienyl)-N-(2-morpholino-1,3-benzothiazol-6-yl)-4-oxo-butanamide CAS Name: 4-(5-methyl-2-thiophenyl)-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-4-oxobutanamide IUPAC Name: 4-(5-methylthiophen-2-yl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-oxobutanamide Traditional Name: 4-keto-4-(5-methyl-2-thienyl)-N-(2-morpholino-1,3-benzothiazol-6-yl)butyramide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C20H21N3O3S2/c1-13-2-6-17(27-13)16(24)5-7-19(25)21-14-3-4-15-18(12-14)28-20(22-15)23-8-10-26-11-9-23/h2-4,6,12H,5,7-11H2,1H3,(H,21,25)