methyl 2-[[8-[(4-azanylcyclohexyl)carbamoyl]-2-thiophen-2-yl-imidazo[1,2-a]pyridin-3-yl]amino]ethanoate

Systemtic Name: methyl 2-[[8-[(4-azanylcyclohexyl)carbamoyl]-2-thiophen-2-yl-imidazo[1,2-a]pyridin-3-yl]amino]ethanoate Openeye Name: methyl 2-[[8-[(4-aminocyclohexyl)carbamoyl]-2-(2-thienyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate CAS Name: 2-[[8-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-thiophen-2-yl-3-imidazo[1,2-a]pyridinyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[8-[(4-aminocyclohexyl)carbamoyl]-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl]amino]acetate Traditional Name: 2-[[8-[(4-aminocyclohexyl)carbamoyl]-2-(2-thienyl)imidazo[1,2-a]pyridin-3-yl]amino]acetic acid methyl ester Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=C(N=C2N1C=CC=C2C(=O)NC3CCC(CC3)N)C4=CC=CS4

Isomeric SMILES

COC(=O)CNC1=C(N=C2N1C=CC=C2C(=O)NC3CCC(CC3)N)C4=CC=CS4

InChI

InChI=1S/C21H25N5O3S/c1-29-17(27)12-23-20-18(16-5-3-11-30-16)25-19-15(4-2-10-26(19)20)21(28)24-14-8-6-13(22)7-9-14/h2-5,10-11,13-14,23H,6-9,12,22H2,1H3,(H,24,28)