(2R)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-2-phenylsulfanyl-propanamide

Systemtic Name: (2R)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-2-phenylsulfanyl-propanamide Openeye Name: (2R)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-2-phenylsulfanyl-propanamide CAS Name: (2R)-N-[(1-methyl-4-piperidin-1-iumylidene)amino]-2-(phenylthio)propanamide IUPAC Name: (2R)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-2-phenylsulfanylpropanamide Traditional Name: (2R)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]-2-(phenylthio)propionamide Formula: C15H22N3OS+ MolecularWeight: 292.41968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=C1CC[NH+](CC1)C)SC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)NN=C1CC[NH+](CC1)C)SC2=CC=CC=C2

InChI

InChI=1S/C15H21N3OS/c1-12(20-14-6-4-3-5-7-14)15(19)17-16-13-8-10-18(2)11-9-13/h3-7,12H,8-11H2,1-2H3,(H,17,19)/p+1/t12-/m1/s1