N-[2-chloranyl-5-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-carbamoyl]phenyl]thiophene-2-carboxamide Formula: C22H17ClN4O3S MolecularWeight: 452.91338

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H17ClN4O3S/c1-27(12-19-24-16-6-3-2-5-14(16)20(28)26-19)22(30)13-8-9-15(23)17(11-13)25-21(29)18-7-4-10-31-18/h2-11H,12H2,1H3,(H,25,29)(H,24,26,28)