3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-oxo-2-[4-(p-tolyl)thiazol-2-yl]propanenitrile CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylphenyl)-2-thiazolyl]-3-oxopropanenitrile IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-oxopropanenitrile Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-keto-2-[4-(p-tolyl)thiazol-2-yl]propionitrile Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H16N2O3S/c1-13-2-4-14(5-3-13)17-12-27-21(23-17)16(11-22)20(24)15-6-7-18-19(10-15)26-9-8-25-18/h2-7,10,12,16H,8-9H2,1H3