[(2S)-4-(1,3-benzothiazol-6-ylcarbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2S)-4-(1,3-benzothiazol-6-ylcarbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2S)-4-(1,3-benzothiazole-6-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidyl)methanone CAS Name: [(2S)-4-[1,3-benzothiazol-6-yl(oxo)methyl]-2,3-dihydro-1,4-benzoxazin-2-yl]-(1-piperidinyl)methanone IUPAC Name: [(2S)-4-(1,3-benzothiazole-6-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2S)-4-(1,3-benzothiazole-6-carbonyl)-2,3-dihydro-1,4-benzoxazin-2-yl]-piperidino-methanone Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H]2CN(C3=CC=CC=C3O2)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C22H21N3O3S/c26-21(15-8-9-16-20(12-15)29-14-23-16)25-13-19(22(27)24-10-4-1-5-11-24)28-18-7-3-2-6-17(18)25/h2-3,6-9,12,14,19H,1,4-5,10-11,13H2/t19-/m0/s1