4-(4-octan-4-ylsulfonylpiperidin-1-yl)-N-[4-(2-oxidanylidene-3,4-dihydro-1,4-benzoxazin-7-yl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(4-octan-4-ylsulfonylpiperidin-1-yl)-N-[4-(2-oxidanylidene-3,4-dihydro-1,4-benzoxazin-7-yl)-1,3-thiazol-2-yl]butanamide Openeye Name: N-[4-(2-oxo-3,4-dihydro-1,4-benzoxazin-7-yl)thiazol-2-yl]-4-[4-(1-propylpentylsulfonyl)-1-piperidyl]butanamide CAS Name: 4-(4-octan-4-ylsulfonyl-1-piperidinyl)-N-[4-(2-oxo-3,4-dihydro-1,4-benzoxazin-7-yl)-2-thiazolyl]butanamide IUPAC Name: 4-(4-octan-4-ylsulfonylpiperidin-1-yl)-N-[4-(2-oxo-3,4-dihydro-1,4-benzoxazin-7-yl)-1,3-thiazol-2-yl]butanamide Traditional Name: N-[4-(2-keto-3,4-dihydro-1,4-benzoxazin-7-yl)thiazol-2-yl]-4-[4-(1-propylpentylsulfonyl)piperidino]butyramide Formula: C28H40N4O5S2 MolecularWeight: 576.771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)S(=O)(=O)C1CCN(CC1)CCCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)NCC(=O)O4

Isomeric SMILES

CCCCC(CCC)S(=O)(=O)C1CCN(CC1)CCCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)NCC(=O)O4

InChI

InChI=1S/C28H40N4O5S2/c1-3-5-8-21(7-4-2)39(35,36)22-12-15-32(16-13-22)14-6-9-26(33)31-28-30-24(19-38-28)20-10-11-23-25(17-20)37-27(34)18-29-23/h10-11,17,19,21-22,29H,3-9,12-16,18H2,1-2H3,(H,30,31,33)