N-[3-[3-[(4-bromophenyl)carbamothioylamino]propoxy]phenyl]ethanamide

Systemtic Name: N-[3-[3-[(4-bromophenyl)carbamothioylamino]propoxy]phenyl]ethanamide Openeye Name: N-[3-[3-[(4-bromophenyl)carbamothioylamino]propoxy]phenyl]acetamide CAS Name: N-[3-[3-[[(4-bromoanilino)-sulfanylidenemethyl]amino]propoxy]phenyl]acetamide IUPAC Name: N-[3-[3-[(4-bromophenyl)carbamothioylamino]propoxy]phenyl]acetamide Traditional Name: N-[3-[3-[(4-bromophenyl)thiocarbamoylamino]propoxy]phenyl]acetamide Formula: C18H20BrN3O2S MolecularWeight: 422.3393

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OCCCNC(=S)NC2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OCCCNC(=S)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H20BrN3O2S/c1-13(23)21-16-4-2-5-17(12-16)24-11-3-10-20-18(25)22-15-8-6-14(19)7-9-15/h2,4-9,12H,3,10-11H2,1H3,(H,21,23)(H2,20,22,25)