N-[5-(diethylaminomethyl)thiophen-2-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide

Systemtic Name: N-[5-(diethylaminomethyl)thiophen-2-yl]-1-methyl-N-(N-oxidanylidenecarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide Openeye Name: N-[5-(diethylaminomethyl)-2-thienyl]-1-methyl-N-(N-oxocarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide CAS Name: N-[5-(diethylaminomethyl)-2-thiophenyl]-N-[imino(nitroso)methyl]-1-methyl-4-(trifluoromethyl)-2-indolecarboxamide IUPAC Name: N-[5-(diethylaminomethyl)thiophen-2-yl]-1-methyl-N-(N-oxocarbamimidoyl)-4-(trifluoromethyl)indole-2-carboxamide Traditional Name: N-[5-(diethylaminomethyl)-2-thienyl]-N-(N-ketoamidino)-1-methyl-4-(trifluoromethyl)indole-2-carboxamide Formula: C21H22F3N5O2S MolecularWeight: 465.49189

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(S1)N(C(=O)C2=CC3=C(C=CC=C3N2C)C(F)(F)F)C(=N)N=O

Isomeric SMILES

CCN(CC)CC1=CC=C(S1)N(C(=O)C2=CC3=C(C=CC=C3N2C)C(F)(F)F)C(=N)N=O

InChI

InChI=1S/C21H22F3N5O2S/c1-4-28(5-2)12-13-9-10-18(32-13)29(20(25)26-31)19(30)17-11-14-15(21(22,23)24)7-6-8-16(14)27(17)3/h6-11,25H,4-5,12H2,1-3H3