1-(2-chloranyl-6-methyl-phenyl)-3-[6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinolin-4-yl]-2-prop-2-ynyl-guanidine

Systemtic Name: 1-(2-chloranyl-6-methyl-phenyl)-3-[6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinolin-4-yl]-2-prop-2-ynyl-guanidine Openeye Name: 1-(2-chloro-6-methyl-phenyl)-3-[6-methoxy-7-[(1-methyl-4-piperidyl)methoxy]-4-quinolyl]-2-prop-2-ynyl-guanidine CAS Name: 1-(2-chloro-6-methylphenyl)-3-[6-methoxy-7-[(1-methyl-4-piperidinyl)methoxy]-4-quinolinyl]-2-prop-2-ynylguanidine IUPAC Name: 1-(2-chloro-6-methylphenyl)-3-[6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinolin-4-yl]-2-prop-2-ynylguanidine Traditional Name: 1-(2-chloro-6-methyl-phenyl)-3-[6-methoxy-7-[(1-methyl-4-piperidyl)methoxy]-4-quinolyl]-2-propargyl-guanidine Formula: C28H32ClN5O2 MolecularWeight: 506.03898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=NCC#C)NC2=C3C=C(C(=CC3=NC=C2)OCC4CCN(CC4)C)OC

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=NCC#C)NC2=C3C=C(C(=CC3=NC=C2)OCC4CCN(CC4)C)OC

InChI

InChI=1S/C28H32ClN5O2/c1-5-12-31-28(33-27-19(2)7-6-8-22(27)29)32-23-9-13-30-24-17-26(25(35-4)16-21(23)24)36-18-20-10-14-34(3)15-11-20/h1,6-9,13,16-17,20H,10-12,14-15,18H2,2-4H3,(H2,30,31,32,33)