tert-butyl 4-quinazolin-4-ylsulfanylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-quinazolin-4-ylsulfanylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-quinazolin-4-ylsulfanylpiperidine-1-carboxylate CAS Name: 4-(4-quinazolinylthio)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-quinazolin-4-ylsulfanylpiperidine-1-carboxylate Traditional Name: 4-(quinazolin-4-ylthio)piperidine-1-carboxylic acid tert-butyl ester Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H23N3O2S/c1-18(2,3)23-17(22)21-10-8-13(9-11-21)24-16-14-6-4-5-7-15(14)19-12-20-16/h4-7,12-13H,8-11H2,1-3H3