2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-oxo-3-quinazolinyl]acetamide IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-4-keto-quinazolin-3-yl]acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C20H20N4O2S/c21-18(25)12-24-19(22-15-7-2-1-6-14(15)20(24)26)13-23-10-5-11-27-17-9-4-3-8-16(17)23/h1-4,6-9H,5,10-13H2,(H2,21,25)