2-[(4-tert-butylphenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-4-oxidanylidene-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(2-furylmethyl)-4-oxo-N-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-(2-furanylmethyl)-4-oxo-N-(2-oxolanylmethyl)-7-quinazolinecarboxamide IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-(furan-2-ylmethyl)-4-oxo-N-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-(2-furfuryl)-4-keto-N-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C30H33N3O4S MolecularWeight: 531.66572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NCC4CCCO4)C(=O)N2CC5=CC=CO5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NCC4CCCO4)C(=O)N2CC5=CC=CO5

InChI

InChI=1S/C30H33N3O4S/c1-30(2,3)22-11-8-20(9-12-22)19-38-29-32-26-16-21(27(34)31-17-23-6-4-14-36-23)10-13-25(26)28(35)33(29)18-24-7-5-15-37-24/h5,7-13,15-16,23H,4,6,14,17-19H2,1-3H3,(H,31,34)