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

Systemtic Name: 4-[(Z)-[5-methyl-3-propan-2-yl-4-(3-pyrrolidin-1-ylpropyl)pyrrol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 4-[(Z)-[3-isopropyl-5-methyl-4-(3-pyrrolidin-1-ylpropyl)pyrrol-2-ylidene]methyl]-5-(2-thienyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[(Z)-[5-methyl-3-propan-2-yl-4-[3-(1-pyrrolidinyl)propyl]-2-pyrrolylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(Z)-[5-methyl-3-propan-2-yl-4-(3-pyrrolidin-1-ylpropyl)pyrrol-2-ylidene]methyl]-5-thiophen-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 4-[(Z)-[3-isopropyl-5-methyl-4-(3-pyrrolidinopropyl)pyrrol-2-ylidene]methyl]-5-(2-thienyl)-3-pyrazolin-3-one Formula: C23H30N4OS MolecularWeight: 410.5755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC2=C(NNC2=O)C3=CC=CS3)C(=C1CCCN4CCCC4)C(C)C

Isomeric SMILES

CC1=N/C(=C\C2=C(NNC2=O)C3=CC=CS3)/C(=C1CCCN4CCCC4)C(C)C

InChI

InChI=1S/C23H30N4OS/c1-15(2)21-17(8-6-12-27-10-4-5-11-27)16(3)24-19(21)14-18-22(25-26-23(18)28)20-9-7-13-29-20/h7,9,13-15H,4-6,8,10-12H2,1-3H3,(H2,25,26,28)/b19-14-