2-[[ethyl-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[2-keto-2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethyl]amino]methyl]-1H-quinazolin-4-one Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCC(SC4=CC=CC=C43)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)N3CCC(SC4=CC=CC=C43)C

InChI

InChI=1S/C23H26N4O2S/c1-3-26(14-21-24-18-9-5-4-8-17(18)23(29)25-21)15-22(28)27-13-12-16(2)30-20-11-7-6-10-19(20)27/h4-11,16H,3,12-15H2,1-2H3,(H,24,25,29)