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

Systemtic Name: 2-[(2S)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Openeye Name: 2-[(1S)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one CAS Name: 2-[[(2S)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-3-(1H-1,2,4-triazol-5-yl)-4-quinazolinone IUPAC Name: 2-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]sulfanyl-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-pyrrolidino-ethyl]thio]-3-(1H-1,2,4-triazol-5-yl)quinazolin-4-one Formula: C17H18N6O2S MolecularWeight: 370.42882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=NN4

Isomeric SMILES

C[C@@H](C(=O)N1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4=NC=NN4

InChI

InChI=1S/C17H18N6O2S/c1-11(14(24)22-8-4-5-9-22)26-17-20-13-7-3-2-6-12(13)15(25)23(17)16-18-10-19-21-16/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H,18,19,21)/t11-/m0/s1