3-[1,4-diazepan-1-yl-(5-methylthiophen-2-yl)methyl]quinoline

Systemtic Name: 3-[1,4-diazepan-1-yl-(5-methylthiophen-2-yl)methyl]quinoline Openeye Name: 3-[1,4-diazepan-1-yl-(5-methyl-2-thienyl)methyl]quinoline CAS Name: 3-[1,4-diazepan-1-yl-(5-methyl-2-thiophenyl)methyl]quinoline IUPAC Name: 3-[1,4-diazepan-1-yl-(5-methylthiophen-2-yl)methyl]quinoline Traditional Name: 3-[1,4-diazepan-1-yl-(5-methyl-2-thienyl)methyl]quinoline Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4

InChI

InChI=1S/C20H23N3S/c1-15-7-8-19(24-15)20(23-11-4-9-21-10-12-23)17-13-16-5-2-3-6-18(16)22-14-17/h2-3,5-8,13-14,20-21H,4,9-12H2,1H3