[4-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)phenyl] 4-methoxybenzoate

Systemtic Name: [4-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)phenyl] 4-methoxybenzoate Openeye Name: [4-(3-amino-2-cyano-3-thioxo-prop-1-enyl)phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)phenyl] ester IUPAC Name: [4-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-(3-amino-2-cyano-3-thioxo-prop-1-enyl)phenyl] ester Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=S)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=S)N

InChI

InChI=1S/C18H14N2O3S/c1-22-15-8-4-13(5-9-15)18(21)23-16-6-2-12(3-7-16)10-14(11-19)17(20)24/h2-10H,1H3,(H2,20,24)