7-methyl-4-[[4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]methyl]-1,4-benzoxazin-3-one

Systemtic Name: 7-methyl-4-[[4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[[4-(4-benzylpiperazine-1-carbonyl)thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one CAS Name: 7-methyl-4-[[4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-thiazolyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[[4-(4-benzylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[[4-(4-benzylpiperazine-1-carbonyl)thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=NC(=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=NC(=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3S/c1-18-7-8-21-22(13-18)32-16-24(30)29(21)15-23-26-20(17-33-23)25(31)28-11-9-27(10-12-28)14-19-5-3-2-4-6-19/h2-8,13,17H,9-12,14-16H2,1H3