3-butyl-1-methyl-1-[4-[6-[methyl(prop-2-enyl)amino]hexoxy]phenyl]thiourea

Systemtic Name: 3-butyl-1-methyl-1-[4-[6-[methyl(prop-2-enyl)amino]hexoxy]phenyl]thiourea Openeye Name: 1-[4-[6-[allyl(methyl)amino]hexoxy]phenyl]-3-butyl-1-methyl-thiourea CAS Name: 3-butyl-1-methyl-1-[4-[6-[methyl(prop-2-enyl)amino]hexoxy]phenyl]thiourea IUPAC Name: 3-butyl-1-methyl-1-[4-[6-[methyl(prop-2-enyl)amino]hexoxy]phenyl]thiourea Traditional Name: 1-[4-[6-[allyl(methyl)amino]hexoxy]phenyl]-3-butyl-1-methyl-thiourea Formula: C22H37N3OS MolecularWeight: 391.61368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)C1=CC=C(C=C1)OCCCCCCN(C)CC=C

Isomeric SMILES

CCCCNC(=S)N(C)C1=CC=C(C=C1)OCCCCCCN(C)CC=C

InChI

InChI=1S/C22H37N3OS/c1-5-7-16-23-22(27)25(4)20-12-14-21(15-13-20)26-19-11-9-8-10-18-24(3)17-6-2/h6,12-15H,2,5,7-11,16-19H2,1,3-4H3,(H,23,27)