3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 3-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-keto-ethyl]quinazolin-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CN2C=NC3=CC=CC=C3C2=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H18N4O2S/c26-19(12-24-13-22-15-7-2-1-6-14(15)21(24)27)25-11-5-9-17(25)20-23-16-8-3-4-10-18(16)28-20/h1-4,6-8,10,13,17H,5,9,11-12H2/t17-/m1/s1