prop-2-enyl (2R,3S)-2-[3-(7-bromanyl-6-ethylsulfanyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-methoxy-piperidine-1-carboxylate

Systemtic Name: prop-2-enyl (2R,3S)-2-[3-(7-bromanyl-6-ethylsulfanyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanylidene-propyl]-3-methoxy-piperidine-1-carboxylate Openeye Name: allyl (2R,3S)-2-[3-(7-bromo-6-ethylsulfanyl-4-oxo-quinazolin-3-yl)-2-oxo-propyl]-3-methoxy-piperidine-1-carboxylate CAS Name: (2R,3S)-2-[3-[7-bromo-6-(ethylthio)-4-oxo-3-quinazolinyl]-2-oxopropyl]-3-methoxy-1-piperidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R,3S)-2-[3-(7-bromo-6-ethylsulfanyl-4-oxoquinazolin-3-yl)-2-oxopropyl]-3-methoxypiperidine-1-carboxylate Traditional Name: (2R,3S)-2-[3-[7-bromo-6-(ethylthio)-4-keto-quinazolin-3-yl]-2-keto-propyl]-3-methoxy-piperidine-1-carboxylic acid allyl ester Formula: C23H28BrN3O5S MolecularWeight: 538.45452

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)CC3C(CCCN3C(=O)OCC=C)OC)Br

Isomeric SMILES

CCSC1=C(C=C2C(=C1)C(=O)N(C=N2)CC(=O)C[C@@H]3[C@H](CCCN3C(=O)OCC=C)OC)Br

InChI

InChI=1S/C23H28BrN3O5S/c1-4-9-32-23(30)27-8-6-7-20(31-3)19(27)10-15(28)13-26-14-25-18-12-17(24)21(33-5-2)11-16(18)22(26)29/h4,11-12,14,19-20H,1,5-10,13H2,2-3H3/t19-,20+/m1/s1