(Z)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-cyano-3-(3-naphthalen-2-yl-1-phenyl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (Z)-N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-cyano-3-(3-naphthalen-2-yl-1-phenyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (Z)-2-cyano-N-(1,1-dioxothiolan-3-yl)-3-[3-(2-naphthyl)-1-phenyl-pyrazol-4-yl]prop-2-enamide CAS Name: (Z)-2-cyano-N-(1,1-dioxo-3-thiolanyl)-3-[3-(2-naphthalenyl)-1-phenyl-4-pyrazolyl]-2-propenamide IUPAC Name: (Z)-2-cyano-N-(1,1-dioxothiolan-3-yl)-3-(3-naphthalen-2-yl-1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (Z)-2-cyano-N-(1,1-diketothiolan-3-yl)-3-[3-(2-naphthyl)-1-phenyl-pyrazol-4-yl]acrylamide Formula: C27H22N4O3S MolecularWeight: 482.55358

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)C(=CC2=CN(N=C2C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)/C(=C\C2=CN(N=C2C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C27H22N4O3S/c28-16-22(27(32)29-24-12-13-35(33,34)18-24)15-23-17-31(25-8-2-1-3-9-25)30-26(23)21-11-10-19-6-4-5-7-20(19)14-21/h1-11,14-15,17,24H,12-13,18H2,(H,29,32)/b22-15-