2-(4-methyl-1,3-thiazol-2-yl)-3-(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 2-(4-methylthiazol-2-yl)-3-(5-morpholino-4-phenyl-2-thienyl)-3-oxo-propanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-[5-(4-morpholinyl)-4-phenyl-2-thiophenyl]-3-oxopropanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-(5-morpholin-4-yl-4-phenylthiophen-2-yl)-3-oxopropanenitrile Traditional Name: 3-keto-2-(4-methylthiazol-2-yl)-3-(5-morpholino-4-phenyl-2-thienyl)propionitrile Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)C2=CC(=C(S2)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S2/c1-14-13-27-20(23-14)17(12-22)19(25)18-11-16(15-5-3-2-4-6-15)21(28-18)24-7-9-26-10-8-24/h2-6,11,13,17H,7-10H2,1H3