5-azanyl-6-cyclopropyl-4-oxidanylidene-2-(prop-2-enylamino)thiopyran-3-carbonitrile

Systemtic Name: 5-azanyl-6-cyclopropyl-4-oxidanylidene-2-(prop-2-enylamino)thiopyran-3-carbonitrile Openeye Name: 2-(allylamino)-5-amino-6-cyclopropyl-4-oxo-thiopyran-3-carbonitrile CAS Name: 5-amino-6-cyclopropyl-4-oxo-2-(prop-2-enylamino)-3-thiopyrancarbonitrile IUPAC Name: 5-amino-6-cyclopropyl-4-oxo-2-(prop-2-enylamino)thiopyran-3-carbonitrile Traditional Name: 2-(allylamino)-5-amino-6-cyclopropyl-4-keto-thiopyran-3-carbonitrile Formula: C12H13N3OS MolecularWeight: 247.31612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C(C(=O)C(=C(S1)C2CC2)N)C#N

Isomeric SMILES

C=CCNC1=C(C(=O)C(=C(S1)C2CC2)N)C#N

InChI

InChI=1S/C12H13N3OS/c1-2-5-15-12-8(6-13)10(16)9(14)11(17-12)7-3-4-7/h2,7,15H,1,3-5,14H2