4-[(1-methylindol-3-yl)methyl]-3-(1,3-thiazol-2-yl)-1,4-dihydropyrazol-5-one

Systemtic Name: 4-[(1-methylindol-3-yl)methyl]-3-(1,3-thiazol-2-yl)-1,4-dihydropyrazol-5-one Openeye Name: 4-[(1-methylindol-3-yl)methyl]-3-thiazol-2-yl-1,4-dihydropyrazol-5-one CAS Name: 4-[(1-methyl-3-indolyl)methyl]-3-(2-thiazolyl)-1,4-dihydropyrazol-5-one IUPAC Name: 4-[(1-methylindol-3-yl)methyl]-3-(1,3-thiazol-2-yl)-1,4-dihydropyrazol-5-one Traditional Name: 4-[(1-methylindol-3-yl)methyl]-5-thiazol-2-yl-2-pyrazolin-3-one Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC3C(=NNC3=O)C4=NC=CS4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC3C(=NNC3=O)C4=NC=CS4

InChI

InChI=1S/C16H14N4OS/c1-20-9-10(11-4-2-3-5-13(11)20)8-12-14(18-19-15(12)21)16-17-6-7-22-16/h2-7,9,12H,8H2,1H3,(H,19,21)