1-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol

Systemtic Name: 1-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol Openeye Name: 1-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol CAS Name: 1-[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]-4-(4-methyl-1-piperazinyl)-2-naphthalenol IUPAC Name: 1-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol Traditional Name: 1-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]thio]-4-(4-methylpiperazino)-2-naphthol Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C3=CC=CC=C32)SC4=NN=C(N4C)C5=CC=CO5)O

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C3=CC=CC=C32)SC4=NN=C(N4C)C5=CC=CO5)O

InChI

InChI=1S/C22H23N5O2S/c1-25-9-11-27(12-10-25)17-14-18(28)20(16-7-4-3-6-15(16)17)30-22-24-23-21(26(22)2)19-8-5-13-29-19/h3-8,13-14,28H,9-12H2,1-2H3