N-cyclopropyl-3-(3-methylpyrazol-1-yl)-N-[[7-methylsulfanyl-2-[methyl(thiophen-3-ylmethyl)amino]quinolin-3-yl]methyl]propanamide

Systemtic Name: N-cyclopropyl-3-(3-methylpyrazol-1-yl)-N-[[7-methylsulfanyl-2-[methyl(thiophen-3-ylmethyl)amino]quinolin-3-yl]methyl]propanamide Openeye Name: N-cyclopropyl-3-(3-methylpyrazol-1-yl)-N-[[7-methylsulfanyl-2-[methyl(3-thienylmethyl)amino]-3-quinolyl]methyl]propanamide CAS Name: N-cyclopropyl-3-(3-methyl-1-pyrazolyl)-N-[[7-(methylthio)-2-[methyl(3-thiophenylmethyl)amino]-3-quinolinyl]methyl]propanamide IUPAC Name: N-cyclopropyl-3-(3-methylpyrazol-1-yl)-N-[[7-methylsulfanyl-2-[methyl(thiophen-3-ylmethyl)amino]quinolin-3-yl]methyl]propanamide Traditional Name: N-cyclopropyl-3-(3-methylpyrazol-1-yl)-N-[[2-[methyl(3-thenyl)amino]-7-(methylthio)-3-quinolyl]methyl]propionamide Formula: C27H31N5OS2 MolecularWeight: 505.69794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCC(=O)N(CC2=C(N=C3C=C(C=CC3=C2)SC)N(C)CC4=CSC=C4)C5CC5

Isomeric SMILES

CC1=NN(C=C1)CCC(=O)N(CC2=C(N=C3C=C(C=CC3=C2)SC)N(C)CC4=CSC=C4)C5CC5

InChI

InChI=1S/C27H31N5OS2/c1-19-8-11-31(29-19)12-9-26(33)32(23-5-6-23)17-22-14-21-4-7-24(34-3)15-25(21)28-27(22)30(2)16-20-10-13-35-18-20/h4,7-8,10-11,13-15,18,23H,5-6,9,12,16-17H2,1-3H3