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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCOC)N=C2SCC4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCCOC)N=C2SCC4=CC(=CC=C4)OC)C

InChI

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