4-[[2-chloranyl-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]-6-methyl-phenyl]amino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]quinoline-3-carbonitrile

Systemtic Name: 4-[[2-chloranyl-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]-6-methyl-phenyl]amino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]quinoline-3-carbonitrile Openeye Name: 4-[2-chloro-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thienyl]-6-methyl-anilino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thienyl]quinoline-3-carbonitrile CAS Name: 4-[2-chloro-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thiophenyl]-6-methylanilino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thiophenyl]-3-quinolinecarbonitrile IUPAC Name: 4-[2-chloro-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]-6-methylanilino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]thiophen-3-yl]quinoline-3-carbonitrile Traditional Name: 4-[2-chloro-4-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thienyl]-6-methyl-anilino]-7-[5-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-3-thienyl]quinoline-3-carbonitrile Formula: C37H34ClN9S2 MolecularWeight: 704.30916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=CSC(=C2)CNCCC3=CN=CN3)Cl)NC4=C5C=CC(=CC5=NC=C4C#N)C6=CSC(=C6)CNCCC7=CN=CN7

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=CSC(=C2)CNCCC3=CN=CN3)Cl)NC4=C5C=CC(=CC5=NC=C4C#N)C6=CSC(=C6)CNCCC7=CN=CN7

InChI

InChI=1S/C37H34ClN9S2/c1-23-8-25(27-10-32(49-20-27)18-41-7-5-30-16-43-22-46-30)11-34(38)36(23)47-37-28(13-39)14-44-35-12-24(2-3-33(35)37)26-9-31(48-19-26)17-40-6-4-29-15-42-21-45-29/h2-3,8-12,14-16,19-22,40-41H,4-7,17-18H2,1H3,(H,42,45)(H,43,46)(H,44,47)