[4-[[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophen-2-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophen-2-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[[5-(2,2-dimethylpropanoylamino)-3-methyl-thiophene-2-carbonyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[[5-[(2,2-dimethyl-1-oxopropyl)amino]-3-methyl-2-thiophenyl]-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[[5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carbonyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: dimethyl-[4-[[[3-methyl-5-(pivaloylamino)thiophene-2-carbonyl]amino]methyl]benzyl]ammonium Formula: C21H30N3O2S+ MolecularWeight: 388.5468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NCC2=CC=C(C=C2)C[NH+](C)C

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NCC2=CC=C(C=C2)C[NH+](C)C

InChI

InChI=1S/C21H29N3O2S/c1-14-11-17(23-20(26)21(2,3)4)27-18(14)19(25)22-12-15-7-9-16(10-8-15)13-24(5)6/h7-11H,12-13H2,1-6H3,(H,22,25)(H,23,26)/p+1