1-butan-2-yl-1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea

Systemtic Name: 1-butan-2-yl-1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea Openeye Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)-1-sec-butyl-thiourea CAS Name: 1-butan-2-yl-1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-[3-(methylthio)phenyl]thiourea IUPAC Name: 1-butan-2-yl-1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea Traditional Name: 1-[(1-butyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-[3-(methylthio)phenyl]-1-sec-butyl-thiourea Formula: C26H37N3S2 MolecularWeight: 455.72208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC2=C1C=CC(=C2)CN(C(C)CC)C(=S)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCCCN1CCCC2=C1C=CC(=C2)CN(C(C)CC)C(=S)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C26H37N3S2/c1-5-7-15-28-16-9-10-22-17-21(13-14-25(22)28)19-29(20(3)6-2)26(30)27-23-11-8-12-24(18-23)31-4/h8,11-14,17-18,20H,5-7,9-10,15-16,19H2,1-4H3,(H,27,30)