2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)quinazolin-4-one

Systemtic Name: 2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)quinazolin-4-one Openeye Name: 2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)quinazolin-4-one CAS Name: 2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-(4-ethoxyphenyl)-4-quinazolinone IUPAC Name: 2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(4-ethoxyphenyl)quinazolin-4-one Traditional Name: 2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-3-p-phenetyl-quinazolin-4-one Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=C(N4C5CC5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=C(N4C5CC5)C

InChI

InChI=1S/C23H23N5O2S/c1-3-30-18-12-10-17(11-13-18)28-21(24-20-7-5-4-6-19(20)22(28)29)14-31-23-26-25-15(2)27(23)16-8-9-16/h4-7,10-13,16H,3,8-9,14H2,1-2H3