5-methyl-4-(phenylmethyl)-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione

Systemtic Name: 5-methyl-4-(phenylmethyl)-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-methyl-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione CAS Name: 5-methyl-4-(phenylmethyl)-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-methyl-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-methyl-2-(9H-xanthen-9-yl)-1,2,4-triazole-3-thione Formula: C23H19N3OS MolecularWeight: 385.48146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC2=CC=CC=C2)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC1=NN(C(=S)N1CC2=CC=CC=C2)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C23H19N3OS/c1-16-24-26(23(28)25(16)15-17-9-3-2-4-10-17)22-18-11-5-7-13-20(18)27-21-14-8-6-12-19(21)22/h2-14,22H,15H2,1H3