2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile

Systemtic Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile Openeye Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile CAS Name: 2-[4-(4-bromophenyl)-2-thiazolyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-propenenitrile IUPAC Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile Traditional Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)acrylonitrile Formula: C20H14BrN3O2S MolecularWeight: 440.31306

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrN3O2S/c21-15-3-1-13(2-4-15)17-12-27-20(24-17)14(10-22)11-23-16-5-6-18-19(9-16)26-8-7-25-18/h1-6,9,11-12,23H,7-8H2