N-(3,4-dihydro-2H-thiochromen-4-yl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: 4-(4-oxo-1H-quinazolin-2-yl)-N-thiochroman-4-yl-butanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-thiochroman-4-yl-butyramide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H21N3O2S/c25-20(23-17-12-13-27-18-9-4-2-6-14(17)18)11-5-10-19-22-16-8-3-1-7-15(16)21(26)24-19/h1-4,6-9,17H,5,10-13H2,(H,23,25)(H,22,24,26)