(5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-7-methylsulfanyl-4,6-bis(oxidanylidene)hept-2-ynenitrile

Systemtic Name: (5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-7-methylsulfanyl-4,6-bis(oxidanylidene)hept-2-ynenitrile Openeye Name: (5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-7-methylsulfanyl-4,6-dioxo-hept-2-ynenitrile CAS Name: (5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-7-(methylthio)-4,6-dioxo-2-heptynenitrile IUPAC Name: (5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-7-methylsulfanyl-4,6-dioxohept-2-ynenitrile Traditional Name: (5Z)-5-(3H-1,3-benzoxazol-2-ylidene)-4,6-diketo-7-(methylthio)hept-2-ynenitrile Formula: C15H10N2O3S MolecularWeight: 298.3165

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)C(=C1NC2=CC=CC=C2O1)C(=O)C#CC#N

Isomeric SMILES

CSCC(=O)/C(=C\1/NC2=CC=CC=C2O1)/C(=O)C#CC#N

InChI

InChI=1S/C15H10N2O3S/c1-21-9-12(19)14(11(18)6-4-8-16)15-17-10-5-2-3-7-13(10)20-15/h2-3,5,7,17H,9H2,1H3/b15-14-