(Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile Openeye Name: (Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile CAS Name: (Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)-2-propenenitrile IUPAC Name: (Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile Traditional Name: (Z)-3-(1,3-benzodioxol-5-ylamino)-2-(1,3-benzothiazol-2-yl)acrylonitrile Formula: C17H11N3O2S MolecularWeight: 321.35314

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC=C(C#N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N/C=C(/C#N)\C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H11N3O2S/c18-8-11(17-20-13-3-1-2-4-16(13)23-17)9-19-12-5-6-14-15(7-12)22-10-21-14/h1-7,9,19H,10H2/b11-9-