N,N-diethyl-4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-phenyl-amino]benzenecarbothioamide

Systemtic Name: N,N-diethyl-4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-phenyl-amino]benzenecarbothioamide Openeye Name: N,N-diethyl-4-(N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)anilino)benzenecarbothioamide CAS Name: N,N-diethyl-4-(N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)anilino)benzenecarbothioamide IUPAC Name: N,N-diethyl-4-(N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)anilino)benzenecarbothioamide Traditional Name: N,N-diethyl-4-(N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)anilino)thiobenzamide Formula: C25H33N3S MolecularWeight: 407.61462

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)C1=CC=C(C=C1)N(C2CC3CCC(C2)N3C)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=S)C1=CC=C(C=C1)N(C2CC3CCC(C2)N3C)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3S/c1-4-27(5-2)25(29)19-11-13-21(14-12-19)28(20-9-7-6-8-10-20)24-17-22-15-16-23(18-24)26(22)3/h6-14,22-24H,4-5,15-18H2,1-3H3