[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]-(1-thiophen-2-ylcarbonylpiperidin-4-yl)methanone

Systemtic Name: [(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]-(1-thiophen-2-ylcarbonylpiperidin-4-yl)methanone Openeye Name: [(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-[1-(thiophene-2-carbonyl)-4-piperidyl]methanone CAS Name: [(2S)-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]-[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]methanone IUPAC Name: [(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone Traditional Name: [(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]-[1-(2-thenoyl)-4-piperidyl]methanone Formula: C25H29N3O4S MolecularWeight: 467.58046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H29N3O4S/c29-23(18-10-14-27(15-11-18)25(31)22-9-6-16-33-22)28-17-21(24(30)26-12-4-1-5-13-26)32-20-8-3-2-7-19(20)28/h2-3,6-9,16,18,21H,1,4-5,10-15,17H2/t21-/m0/s1