1-[(3S,4S)-5-cyclopentyl-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydropyrazol-4-yl]-1,2,4-triazole

Systemtic Name: 1-[(3S,4S)-5-cyclopentyl-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydropyrazol-4-yl]-1,2,4-triazole Openeye Name: 1-[(3S,4S)-5-cyclopentyl-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydropyrazol-4-yl]-1,2,4-triazole CAS Name: 1-[(3S,4S)-5-cyclopentyl-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydropyrazol-4-yl]-1,2,4-triazole IUPAC Name: 1-[(3S,4S)-5-cyclopentyl-3-(4-methoxyphenyl)-2-phenyl-3,4-dihydropyrazol-4-yl]-1,2,4-triazole Traditional Name: 1-[(4S,5S)-3-cyclopentyl-5-(4-methoxyphenyl)-1-phenyl-2-pyrazolin-4-yl]-1,2,4-triazole Formula: C23H20N5O MolecularWeight: 382.4378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=NN2C3=CC=CC=C3)[C]4[CH][CH][CH][CH]4)N5C=NC=N5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@@H](C(=NN2C3=CC=CC=C3)[C]4[CH][CH][CH][CH]4)N5C=NC=N5

InChI

InChI=1S/C23H20N5O/c1-29-20-13-11-18(12-14-20)22-23(27-16-24-15-25-27)21(17-7-5-6-8-17)26-28(22)19-9-3-2-4-10-19/h2-16,22-23H,1H3/t22-,23+/m0/s1