6-chloranyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[[(1R)-2-keto-1-methyl-2-pyrrolidino-ethyl]thio]quinazolin-4-one Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

C[C@H](C(=O)N1CCCC1)SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C18H20ClN3O2S/c1-3-8-22-17(24)14-11-13(19)6-7-15(14)20-18(22)25-12(2)16(23)21-9-4-5-10-21/h3,6-7,11-12H,1,4-5,8-10H2,2H3/t12-/m1/s1