N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-5-methyl-2-phenyl-triazole-4-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-5-methyl-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-5-methyl-2-phenyltriazole-4-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-5-methyl-2-phenyl-triazole-4-carboxamide Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2CCS(=O)(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)N[C@H]2CCS(=O)(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C14H16N4O3S/c1-10-13(14(19)15-11-7-8-22(20,21)9-11)17-18(16-10)12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3,(H,15,19)/t11-/m0/s1