(2R)-2-methyl-4-[3-oxidanylidene-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propyl]-1,4-benzoxazin-3-one

Systemtic Name: (2R)-2-methyl-4-[3-oxidanylidene-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propyl]-1,4-benzoxazin-3-one Openeye Name: (2R)-2-methyl-4-[3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one CAS Name: (2R)-2-methyl-4-[3-oxo-3-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]propyl]-1,4-benzoxazin-3-one IUPAC Name: (2R)-2-methyl-4-[3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]propyl]-1,4-benzoxazin-3-one Traditional Name: (2R)-4-[3-keto-3-[4-(2-thenoyl)piperazino]propyl]-2-methyl-1,4-benzoxazin-3-one Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H23N3O4S/c1-15-20(26)24(16-5-2-3-6-17(16)28-15)9-8-19(25)22-10-12-23(13-11-22)21(27)18-7-4-14-29-18/h2-7,14-15H,8-13H2,1H3/t15-/m1/s1