7-chloranyl-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C14H14ClN5O2S MolecularWeight: 351.81126

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=NN=C1SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

COCCN1C=NN=C1SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C14H14ClN5O2S/c1-22-5-4-20-8-16-19-14(20)23-7-12-17-11-6-9(15)2-3-10(11)13(21)18-12/h2-3,6,8H,4-5,7H2,1H3,(H,17,18,21)