N-[(2R)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2R)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1R)-1-[[2-(dimethylaminomethyl)phenyl]methylcarbamoyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[(2R)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2R)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[(1R)-1-[[2-(dimethylaminomethyl)benzyl]carbamoyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)NCC2=CC=CC=C2CN(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@H](CCSC)C(=O)NCC2=CC=CC=C2CN(C)C

InChI

InChI=1S/C23H31N3O2S/c1-17-8-7-11-18(14-17)22(27)25-21(12-13-29-4)23(28)24-15-19-9-5-6-10-20(19)16-26(2)3/h5-11,14,21H,12-13,15-16H2,1-4H3,(H,24,28)(H,25,27)/t21-/m1/s1