2-[(2,5-dimethylphenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-4-keto-N-(2-methoxyethyl)-3-(4-methoxyphenyl)quinazoline-7-carboxamide Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC3=C(C=CC(=C3)C(=O)NCCOC)C(=O)N2C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H29N3O4S/c1-18-5-6-19(2)21(15-18)17-36-28-30-25-16-20(26(32)29-13-14-34-3)7-12-24(25)27(33)31(28)22-8-10-23(35-4)11-9-22/h5-12,15-16H,13-14,17H2,1-4H3,(H,29,32)