2-cyano-3-(1,3-dihydro-2-benzofuran-5-ylamino)prop-2-enethioamide

Systemtic Name: 2-cyano-3-(1,3-dihydro-2-benzofuran-5-ylamino)prop-2-enethioamide Openeye Name: 2-cyano-3-(1,3-dihydroisobenzofuran-5-ylamino)prop-2-enethioamide CAS Name: 2-cyano-3-(1,3-dihydroisobenzofuran-5-ylamino)-2-propenethioamide IUPAC Name: 2-cyano-3-(1,3-dihydro-2-benzofuran-5-ylamino)prop-2-enethioamide Traditional Name: 2-cyano-3-(phthalan-5-ylamino)thioacrylamide Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CO1)C=C(C=C2)NC=C(C#N)C(=S)N

Isomeric SMILES

C1C2=C(CO1)C=C(C=C2)NC=C(C#N)C(=S)N

InChI

InChI=1S/C12H11N3OS/c13-4-10(12(14)17)5-15-11-2-1-8-6-16-7-9(8)3-11/h1-3,5,15H,6-7H2,(H2,14,17)