2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(6-methoxy-2-phenyl-4-quinazolinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(6-methoxy-2-phenylquinazolin-4-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(6-methoxy-2-phenyl-quinazolin-4-yl)thio]-1-pyrrolidino-ethanone Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c1-26-16-9-10-18-17(13-16)21(27-14-19(25)24-11-5-6-12-24)23-20(22-18)15-7-3-2-4-8-15/h2-4,7-10,13H,5-6,11-12,14H2,1H3