(2S)-2-(aminocarbonylamino)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-methyl-butanamide Openeye Name: (2S)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-methyl-2-ureido-butanamide CAS Name: (2S)-2-(carbamoylamino)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-methylbutanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-methylbutanamide Traditional Name: (2S)-N-[4-(dimethylaminomethyl)benzyl]-3-methyl-2-ureido-butyramide Formula: C16H26N4O2 MolecularWeight: 306.40324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN(C)C)NC(=O)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(C=C1)CN(C)C)NC(=O)N

InChI

InChI=1S/C16H26N4O2/c1-11(2)14(19-16(17)22)15(21)18-9-12-5-7-13(8-6-12)10-20(3)4/h5-8,11,14H,9-10H2,1-4H3,(H,18,21)(H3,17,19,22)/t14-/m0/s1