1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(2-furylmethyl)thiourea CAS Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(2-furanylmethyl)thiourea IUPAC Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(furan-2-ylmethyl)thiourea Traditional Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-ethylphenyl)-1-(2-furfuryl)thiourea Formula: C28H35N3OS MolecularWeight: 461.662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC2=C1C=CC(=C2)CN(CC3=CC=CO3)C(=S)NC4=CC=CC(=C4)CC

Isomeric SMILES

CCCCN1CCCC2=C1C=CC(=C2)CN(CC3=CC=CO3)C(=S)NC4=CC=CC(=C4)CC

InChI

InChI=1S/C28H35N3OS/c1-3-5-15-30-16-7-10-24-18-23(13-14-27(24)30)20-31(21-26-12-8-17-32-26)28(33)29-25-11-6-9-22(4-2)19-25/h6,8-9,11-14,17-19H,3-5,7,10,15-16,20-21H2,1-2H3,(H,29,33)