2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C15H12N6OS2 MolecularWeight: 356.42538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NN=C(N3N)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NN=C(N3N)C4=CC=CS4

InChI

InChI=1S/C15H12N6OS2/c16-21-13(11-6-3-7-23-11)19-20-15(21)24-8-12-17-10-5-2-1-4-9(10)14(22)18-12/h1-7H,8,16H2,(H,17,18,22)