4-[(Z)-[3-cyclopropyl-5-methyl-4-(2-pyrrolidin-1-ylethyl)pyrrol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(Z)-[3-cyclopropyl-5-methyl-4-(2-pyrrolidin-1-ylethyl)pyrrol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-[3-cyclopropyl-5-methyl-4-(2-pyrrolidin-1-ylethyl)pyrrol-2-ylidene]methyl]-5-(2-thienyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-[3-cyclopropyl-5-methyl-4-[2-(1-pyrrolidinyl)ethyl]-2-pyrrolylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-[3-cyclopropyl-5-methyl-4-(2-pyrrolidin-1-ylethyl)pyrrol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-[3-cyclopropyl-5-methyl-4-(2-pyrrolidinoethyl)pyrrol-2-ylidene]methyl]-5-(2-thienyl)-3-pyrazolin-3-one Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=C(NNC2=O)C3=CC=CS3)C(=C1CCN4CCCC4)C5CC5

Isomeric SMILES

CC1=N/C(=C\C2=C(NNC2=O)C3=CC=CS3)/C(=C1CCN4CCCC4)C5CC5

InChI

InChI=1S/C22H26N4OS/c1-14-16(8-11-26-9-2-3-10-26)20(15-6-7-15)18(23-14)13-17-21(24-25-22(17)27)19-5-4-12-28-19/h4-5,12-13,15H,2-3,6-11H2,1H3,(H2,24,25,27)/b18-13-