6-chloranyl-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 6-chloro-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]quinazolin-4-one Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C19H16ClN3O3S/c1-3-9-22-18(24)16-11-14(20)7-8-17(16)21-19(22)27-12(2)13-5-4-6-15(10-13)23(25)26/h3-8,10-12H,1,9H2,2H3/t12-/m1/s1