N-butyl-3-[methyl(phenyl)amino]pyrrolidine-1-carbothioamide hydrochloride

Systemtic Name: N-butyl-3-[methyl(phenyl)amino]pyrrolidine-1-carbothioamide hydrochloride Openeye Name: N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide hydrochloride CAS Name: N-butyl-3-(N-methylanilino)-1-pyrrolidinecarbothioamide hydrochloride IUPAC Name: N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide hydrochloride Traditional Name: N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide hydrochloride Formula: C16H26ClN3S MolecularWeight: 327.91574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCC(C1)N(C)C2=CC=CC=C2.Cl

Isomeric SMILES

CCCCNC(=S)N1CCC(C1)N(C)C2=CC=CC=C2.Cl

InChI

InChI=1S/C16H25N3S.ClH/c1-3-4-11-17-16(20)19-12-10-15(13-19)18(2)14-8-6-5-7-9-14;/h5-9,15H,3-4,10-13H2,1-2H3,(H,17,20);1H