[2-(tert-butylamino)-2-oxidanylidene-ethyl]-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-[2-[(4-cyclopropyl-3-ethoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-[2-[(4-cyclopropyl-3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-[2-[(4-cyclopropyl-3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-[2-[(3-carbethoxy-4-cyclopropyl-2-thienyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H30N3O4S+ MolecularWeight: 396.5242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)C[NH+](C)CC(=O)NC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)C[NH+](C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C19H29N3O4S/c1-6-26-18(25)16-13(12-7-8-12)11-27-17(16)20-14(23)9-22(5)10-15(24)21-19(2,3)4/h11-12H,6-10H2,1-5H3,(H,20,23)(H,21,24)/p+1