N-cyclohexyl-2-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl-quinolin-3-yl-amino]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-cyclohexyl-2-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl-quinolin-3-yl-amino]-2-thiophen-2-yl-ethanamide Openeye Name: N-cyclohexyl-2-[[2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]-(3-quinolyl)amino]-2-(2-thienyl)acetamide CAS Name: N-cyclohexyl-2-[[2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-1-oxoethyl]-(3-quinolinyl)amino]-2-thiophen-2-ylacetamide IUPAC Name: N-cyclohexyl-2-[[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetyl]-quinolin-3-ylamino]-2-thiophen-2-ylacetamide Traditional Name: N-cyclohexyl-2-[[2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]-(3-quinolyl)amino]-2-(2-thienyl)acetamide Formula: C29H31N5O4S2 MolecularWeight: 577.71754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC(=O)N(C2=CC3=CC=CC=C3N=C2)C(C4=CC=CS4)C(=O)NC5CCCCC5

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC(=O)N(C2=CC3=CC=CC=C3N=C2)C(C4=CC=CS4)C(=O)NC5CCCCC5

InChI

InChI=1S/C29H31N5O4S2/c1-19-14-25(33-38-19)32-26(35)17-39-18-27(36)34(22-15-20-8-5-6-11-23(20)30-16-22)28(24-12-7-13-40-24)29(37)31-21-9-3-2-4-10-21/h5-8,11-16,21,28H,2-4,9-10,17-18H2,1H3,(H,31,37)(H,32,33,35)