2-[(1S)-1-phenylethyl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one

Systemtic Name: 2-[(1S)-1-phenylethyl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Openeye Name: 2-[(1S)-1-phenylethyl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one CAS Name: 2-[[(1S)-1-phenylethyl]thio]-3-(1H-1,2,4-triazol-5-yl)-4-quinazolinone IUPAC Name: 2-[(1S)-1-phenylethyl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Traditional Name: 2-[[(1S)-1-phenylethyl]thio]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=NN4

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=NN4

InChI

InChI=1S/C18H15N5OS/c1-12(13-7-3-2-4-8-13)25-18-21-15-10-6-5-9-14(15)16(24)23(18)17-19-11-20-22-17/h2-12H,1H3,(H,19,20,22)/t12-/m0/s1