2-(2-azanyl-4-methyl-phenyl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(2-azanyl-4-methyl-phenyl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2-amino-4-methyl-phenyl)sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(2-amino-4-methylphenyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2-amino-4-methylphenyl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(2-amino-4-methyl-phenyl)thio]-1-pyrrolidino-ethanone Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)N2CCCC2)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)N2CCCC2)N

InChI

InChI=1S/C13H18N2OS/c1-10-4-5-12(11(14)8-10)17-9-13(16)15-6-2-3-7-15/h4-5,8H,2-3,6-7,9,14H2,1H3