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

Systemtic Name: 3-[3-oxidanylidene-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propyl]-1,4-benzoxazin-2-one Openeye Name: 3-[3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]propyl]-1,4-benzoxazin-2-one CAS Name: 3-[3-oxo-3-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]propyl]-1,4-benzoxazin-2-one IUPAC Name: 3-[3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]propyl]-1,4-benzoxazin-2-one Traditional Name: 3-[3-keto-3-[4-(2-thenoyl)piperazino]propyl]-1,4-benzoxazin-2-one Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3OC2=O)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3OC2=O)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H19N3O4S/c24-18(8-7-15-20(26)27-16-5-2-1-4-14(16)21-15)22-9-11-23(12-10-22)19(25)17-6-3-13-28-17/h1-6,13H,7-12H2