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

Systemtic Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)thiazol-4-yl]benzonitrile CAS Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-thiazolyl]benzonitrile IUPAC Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3-thiazol-4-yl]benzonitrile Traditional Name: 4-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)thiazol-4-yl]benzonitrile Formula: C18H13N3O2S MolecularWeight: 335.37972

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=CS3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=CS3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H13N3O2S/c19-10-12-1-3-13(4-2-12)15-11-24-18(21-15)20-14-5-6-16-17(9-14)23-8-7-22-16/h1-6,9,11H,7-8H2,(H,20,21)