1-(3-methoxypropyl)-3-[4-[4-(3-methoxypropylcarbamothioylamino)phenoxy]phenyl]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[4-[4-(3-methoxypropylcarbamothioylamino)phenoxy]phenyl]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[4-[4-(3-methoxypropylcarbamothioylamino)phenoxy]phenyl]thiourea CAS Name: 1-(3-methoxypropyl)-3-[4-[4-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]phenoxy]phenyl]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[4-[4-(3-methoxypropylcarbamothioylamino)phenoxy]phenyl]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[4-[4-(3-methoxypropylthiocarbamoylamino)phenoxy]phenyl]thiourea Formula: C22H30N4O3S2 MolecularWeight: 462.6286

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NCCCOC

Isomeric SMILES

COCCCNC(=S)NC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NCCCOC

InChI

InChI=1S/C22H30N4O3S2/c1-27-15-3-13-23-21(30)25-17-5-9-19(10-6-17)29-20-11-7-18(8-12-20)26-22(31)24-14-4-16-28-2/h5-12H,3-4,13-16H2,1-2H3,(H2,23,25,30)(H2,24,26,31)