[2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] N,N-dipropylcarbamodithioate

Systemtic Name: [2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-oxidanylidene-ethyl] N,N-dipropylcarbamodithioate Openeye Name: [2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-oxo-ethyl] N,N-dipropylcarbamodithioate CAS Name: N,N-dipropylcarbamodithioic acid [2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-2-oxoethyl] N,N-dipropylcarbamodithioate Traditional Name: N,N-dipropylcarbamodithioic acid [2-(3,5-diphenyl-2-pyrazolin-1-yl)-2-keto-ethyl] ester Formula: C24H29N3OS2 MolecularWeight: 439.63656

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=S)SCC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCN(CCC)C(=S)SCC(=O)N1C(CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3OS2/c1-3-15-26(16-4-2)24(29)30-18-23(28)27-22(20-13-9-6-10-14-20)17-21(25-27)19-11-7-5-8-12-19/h5-14,22H,3-4,15-18H2,1-2H3