2-[(5Z)-5-(4-methoxy-6-sulfanylidene-cyclohexa-2,4-dien-1-ylidene)-2-phenyl-1H-pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[(5Z)-5-(4-methoxy-6-sulfanylidene-cyclohexa-2,4-dien-1-ylidene)-2-phenyl-1H-pyrazol-4-yl]ethanenitrile Openeye Name: 2-[(5Z)-5-(4-methoxy-6-thioxo-cyclohexa-2,4-dien-1-ylidene)-2-phenyl-1H-pyrazol-4-yl]acetonitrile CAS Name: 2-[(5Z)-5-(4-methoxy-6-sulfanylidene-1-cyclohexa-2,4-dienylidene)-2-phenyl-1H-pyrazol-4-yl]acetonitrile IUPAC Name: 2-[(5Z)-5-(4-methoxy-6-sulfanylidenecyclohexa-2,4-dien-1-ylidene)-2-phenyl-1H-pyrazol-4-yl]acetonitrile Traditional Name: 2-[(3Z)-3-(4-methoxy-6-thioxo-cyclohexa-2,4-dien-1-ylidene)-1-phenyl-3-pyrazolin-4-yl]acetonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=S)C(=C2C(=CN(N2)C3=CC=CC=C3)CC#N)C=C1

Isomeric SMILES

COC1=CC(=S)/C(=C\2/C(=CN(N2)C3=CC=CC=C3)CC#N)/C=C1

InChI

InChI=1S/C18H15N3OS/c1-22-15-7-8-16(17(23)11-15)18-13(9-10-19)12-21(20-18)14-5-3-2-4-6-14/h2-8,11-12,20H,9H2,1H3/b18-16-