(5R)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5R)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5R)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5R)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5R)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5R)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(S3)CCC(C4)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(S3)CC[C@H](C4)C

InChI

InChI=1S/C21H22ClN3O2S/c1-3-25(21(27)18-9-13-8-12(2)4-7-17(13)28-18)11-19-23-16-10-14(22)5-6-15(16)20(26)24-19/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,23,24,26)/t12-/m1/s1