(2S)-N-cyclohexyl-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide

Systemtic Name: (2S)-N-cyclohexyl-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Openeye Name: (2S)-N-cyclohexyl-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide CAS Name: (2S)-N-cyclohexyl-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazine-4-carbothioamide IUPAC Name: (2S)-N-cyclohexyl-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Traditional Name: (2S)-N-cyclohexyl-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazine-4-carbothioamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

Isomeric SMILES

C1CCC(CC1)NC(=S)N2C[C@H](OC3=CC=CC=C32)C(=O)N4CCCCC4

InChI

InChI=1S/C21H29N3O2S/c25-20(23-13-7-2-8-14-23)19-15-24(17-11-5-6-12-18(17)26-19)21(27)22-16-9-3-1-4-10-16/h5-6,11-12,16,19H,1-4,7-10,13-15H2,(H,22,27)/t19-/m0/s1