3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-(5-thiophen-2-ylthiophen-2-yl)quinazolin-4-one

Systemtic Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-(5-thiophen-2-ylthiophen-2-yl)quinazolin-4-one Openeye Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-[5-(2-thienyl)-2-thienyl]quinazolin-4-one CAS Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-(5-thiophen-2-yl-2-thiophenyl)-4-quinazolinone IUPAC Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-(5-thiophen-2-ylthiophen-2-yl)quinazolin-4-one Traditional Name: 3-[[3-(aminomethyl)cyclohexyl]methyl]-6-methoxy-2-[5-(2-thienyl)-2-thienyl]quinazolin-4-one Formula: C25H27N3O2S2 MolecularWeight: 465.63078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC=C(S4)C5=CC=CS5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N(C2=O)CC3CCCC(C3)CN)C4=CC=C(S4)C5=CC=CS5

InChI

InChI=1S/C25H27N3O2S2/c1-30-18-7-8-20-19(13-18)25(29)28(15-17-5-2-4-16(12-17)14-26)24(27-20)23-10-9-22(32-23)21-6-3-11-31-21/h3,6-11,13,16-17H,2,4-5,12,14-15,26H2,1H3