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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(S3)CCCC4

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C21H22ClN3O2S/c1-2-9-25(21(27)18-10-13-5-3-4-6-17(13)28-18)12-19-23-16-11-14(22)7-8-15(16)20(26)24-19/h7-8,10-11H,2-6,9,12H2,1H3,(H,23,24,26)