2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[(4-chlorophenyl)methyl]-N-(2-methoxyethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-(4-chlorobenzyl)-4-keto-N-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C30H32ClN3O3S MolecularWeight: 550.11138

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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)NCCOC)C(=O)N2CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H32ClN3O3S/c1-30(2,3)23-10-5-21(6-11-23)19-38-29-33-26-17-22(27(35)32-15-16-37-4)9-14-25(26)28(36)34(29)18-20-7-12-24(31)13-8-20/h5-14,17H,15-16,18-19H2,1-4H3,(H,32,35)