1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]ethanone Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC(=NC4=CC=CC=C43)CN5CCOCC5

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC(=NC4=CC=CC=C43)CN5CCOCC5

InChI

InChI=1S/C24H28N4O2S/c1-16-13-20(17(2)28(16)18-7-8-18)22(29)15-31-24-19-5-3-4-6-21(19)25-23(26-24)14-27-9-11-30-12-10-27/h3-6,13,18H,7-12,14-15H2,1-2H3