2-[[(3-chloranyl-1-benzothiophen-2-yl)methyl-ethyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[(3-chloranyl-1-benzothiophen-2-yl)methyl-ethyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[(3-chlorobenzothiophen-2-yl)methyl-ethyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)methyl-ethylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[(3-chloro-1-benzothiophen-2-yl)methyl-ethylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[(3-chlorobenzothiophen-2-yl)methyl-ethyl-amino]methyl]-1H-quinazolin-4-one Formula: C20H18ClN3OS MolecularWeight: 383.89442

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C2=CC=CC=C2S1)Cl)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCN(CC1=C(C2=CC=CC=C2S1)Cl)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H18ClN3OS/c1-2-24(11-17-19(21)14-8-4-6-10-16(14)26-17)12-18-22-15-9-5-3-7-13(15)20(25)23-18/h3-10H,2,11-12H2,1H3,(H,22,23,25)