(3S)-N-[(Z)-(4-tert-butylphenyl)methylideneamino]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(Z)-(4-tert-butylphenyl)methylideneamino]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[(Z)-(4-tert-butylphenyl)methyleneamino]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-[(Z)-(4-tert-butylphenyl)methylideneamino]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(Z)-(4-tert-butylphenyl)methylideneamino]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[(Z)-(4-tert-butylbenzylidene)amino]-1-mesyl-nipecotamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=N\NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C18H27N3O3S/c1-18(2,3)16-9-7-14(8-10-16)12-19-20-17(22)15-6-5-11-21(13-15)25(4,23)24/h7-10,12,15H,5-6,11,13H2,1-4H3,(H,20,22)/b19-12-/t15-/m0/s1