N-(2-azanylethyl)-3-(tert-butylamino)-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine-7-carboxamide

Systemtic Name: N-(2-azanylethyl)-3-(tert-butylamino)-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine-7-carboxamide Openeye Name: N-(2-aminoethyl)-3-(tert-butylamino)-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine-7-carboxamide CAS Name: N-(2-aminoethyl)-3-(tert-butylamino)-2-[4-(methylthio)phenyl]-7-imidazo[1,2-a]pyridinecarboxamide IUPAC Name: N-(2-aminoethyl)-3-(tert-butylamino)-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine-7-carboxamide Traditional Name: N-(2-aminoethyl)-3-(tert-butylamino)-2-[4-(methylthio)phenyl]imidazo[1,2-a]pyridine-7-carboxamide Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=C2N1C=CC(=C2)C(=O)NCCN)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)NC1=C(N=C2N1C=CC(=C2)C(=O)NCCN)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H27N5OS/c1-21(2,3)25-19-18(14-5-7-16(28-4)8-6-14)24-17-13-15(9-12-26(17)19)20(27)23-11-10-22/h5-9,12-13,25H,10-11,22H2,1-4H3,(H,23,27)