[2-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(3,3-diphenylpropyl)azanium

Systemtic Name: [2-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-(3,3-diphenylpropyl)azanium Openeye Name: [2-[(3-carbamoyl-4,5-dimethyl-2-thienyl)amino]-2-oxo-ethyl]-(3,3-diphenylpropyl)ammonium CAS Name: [2-[(3-carbamoyl-4,5-dimethyl-2-thiophenyl)amino]-2-oxoethyl]-(3,3-diphenylpropyl)ammonium IUPAC Name: [2-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)amino]-2-oxoethyl]-(3,3-diphenylpropyl)azanium Traditional Name: [2-[(3-carbamoyl-4,5-dimethyl-2-thienyl)amino]-2-keto-ethyl]-(3,3-diphenylpropyl)ammonium Formula: C24H28N3O2S+ MolecularWeight: 422.56302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H27N3O2S/c1-16-17(2)30-24(22(16)23(25)29)27-21(28)15-26-14-13-20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,20,26H,13-15H2,1-2H3,(H2,25,29)(H,27,28)/p+1