4-(aminomethyl)-N-[1-(4-chlorophenyl)sulfanyl-4-methyl-pentan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-(4-chlorophenyl)sulfanyl-4-methyl-pentan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-butyl]pyrrolidine-2-carboxamide CAS Name: 4-(aminomethyl)-N-[1-[(4-chlorophenyl)thio]-4-methylpentan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-(4-chlorophenyl)sulfanyl-4-methylpentan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[[(4-chlorophenyl)thio]methyl]-3-methyl-butyl]pyrrolidine-2-carboxamide Formula: C18H28ClN3OS MolecularWeight: 369.95242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CSC1=CC=C(C=C1)Cl)NC(=O)C2CC(CN2)CN

Isomeric SMILES

CC(C)CC(CSC1=CC=C(C=C1)Cl)NC(=O)C2CC(CN2)CN

InChI

InChI=1S/C18H28ClN3OS/c1-12(2)7-15(11-24-16-5-3-14(19)4-6-16)22-18(23)17-8-13(9-20)10-21-17/h3-6,12-13,15,17,21H,7-11,20H2,1-2H3,(H,22,23)