2-[(3-methoxyphenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide Openeye Name: 3-isobutyl-N-isopropyl-2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(3-methoxyphenyl)methylthio]-3-(2-methylpropyl)-4-oxo-N-propan-2-yl-7-quinazolinecarboxamide IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-(2-methylpropyl)-4-oxo-N-propan-2-ylquinazoline-7-carboxamide Traditional Name: 3-isobutyl-N-isopropyl-4-keto-2-(m-anisylthio)quinazoline-7-carboxamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC(C)C)N=C1SCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC(C)C)N=C1SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H29N3O3S/c1-15(2)13-27-23(29)20-10-9-18(22(28)25-16(3)4)12-21(20)26-24(27)31-14-17-7-6-8-19(11-17)30-5/h6-12,15-16H,13-14H2,1-5H3,(H,25,28)