N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C20H23N5O3S/c1-15-11-19(25(23-15)18-9-10-29(27,28)14-18)22-20(26)8-7-16-12-21-24(13-16)17-5-3-2-4-6-17/h2-6,11-13,18H,7-10,14H2,1H3,(H,22,26)