2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(4-methoxyphenyl)pyrazol-3-amine

Systemtic Name: 2-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(4-methoxyphenyl)pyrazol-3-amine Openeye Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-4-(4-methoxyphenyl)pyrazol-3-amine CAS Name: 2-[(3S)-1,1-dioxo-3-thiolanyl]-4-(4-methoxyphenyl)-3-pyrazolamine IUPAC Name: 2-[(3S)-1,1-dioxothiolan-3-yl]-4-(4-methoxyphenyl)pyrazol-3-amine Traditional Name: [2-[(3S)-1,1-diketothiolan-3-yl]-4-(4-methoxyphenyl)pyrazol-3-yl]amine Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(N=C2)C3CCS(=O)(=O)C3)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(N=C2)[C@H]3CCS(=O)(=O)C3)N

InChI

InChI=1S/C14H17N3O3S/c1-20-12-4-2-10(3-5-12)13-8-16-17(14(13)15)11-6-7-21(18,19)9-11/h2-5,8,11H,6-7,9,15H2,1H3/t11-/m0/s1