2-[2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one

Systemtic Name: 2-[2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one Openeye Name: 2-[2-hydroxy-3-(2-thienylmethoxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one CAS Name: 2-[2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one IUPAC Name: 2-[2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one Traditional Name: 2-[2-hydroxy-3-(2-thenyloxy)propyl]-5,6-diphenyl-1,2,4-triazin-3-one Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=CC=C3)CC(COCC4=CC=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=CC=C3)CC(COCC4=CC=CS4)O

InChI

InChI=1S/C23H21N3O3S/c27-19(15-29-16-20-12-7-13-30-20)14-26-23(28)24-21(17-8-3-1-4-9-17)22(25-26)18-10-5-2-6-11-18/h1-13,19,27H,14-16H2