1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-[benzyl(isopropyl)amino]-1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C23H25N3OS2 MolecularWeight: 423.5941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C23H25N3OS2/c1-17(2)25(15-18-8-4-3-5-9-18)16-23(27)26-20(22-11-7-13-29-22)14-19(24-26)21-10-6-12-28-21/h3-13,17,20H,14-16H2,1-2H3