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

Systemtic Name: 4-[[4-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one Openeye Name: 4-[[4-(4-benzhydrylpiperazine-1-carbonyl)thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one CAS Name: 4-[[4-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]methyl]-7-methyl-1,4-benzoxazin-3-one IUPAC Name: 4-[[4-(4-benzhydrylpiperazine-1-carbonyl)-1,3-thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one Traditional Name: 4-[[4-(4-benzhydrylpiperazine-1-carbonyl)thiazol-2-yl]methyl]-7-methyl-1,4-benzoxazin-3-one Formula: C31H30N4O3S MolecularWeight: 538.6599

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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)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=NC(=CS3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H30N4O3S/c1-22-12-13-26-27(18-22)38-20-29(36)35(26)19-28-32-25(21-39-28)31(37)34-16-14-33(15-17-34)30(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-13,18,21,30H,14-17,19-20H2,1H3