7-chloranyl-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one Openeye Name: 7-chloro-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one CAS Name: 7-chloro-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one Traditional Name: 7-chloro-2-(3,4-dihydro-2H-1,5-benzothiazepin-5-ylmethyl)-1H-quinazolin-4-one Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C18H16ClN3OS/c19-12-6-7-13-14(10-12)20-17(21-18(13)23)11-22-8-3-9-24-16-5-2-1-4-15(16)22/h1-2,4-7,10H,3,8-9,11H2,(H,20,21,23)