1-(3-bromophenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea

Systemtic Name: 1-(3-bromophenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea Openeye Name: 1-(3-bromophenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea CAS Name: 1-[[(3-bromoanilino)-sulfanylidenemethyl]amino]-3-(3-ethoxypropyl)thiourea IUPAC Name: 1-(3-bromophenyl)-3-(3-ethoxypropylcarbamothioylamino)thiourea Traditional Name: 1-(3-bromophenyl)-3-(3-ethoxypropylthiocarbamoylamino)thiourea Formula: C13H19BrN4OS2 MolecularWeight: 391.35016

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)Br

Isomeric SMILES

CCOCCCNC(=S)NNC(=S)NC1=CC(=CC=C1)Br

InChI

InChI=1S/C13H19BrN4OS2/c1-2-19-8-4-7-15-12(20)17-18-13(21)16-11-6-3-5-10(14)9-11/h3,5-6,9H,2,4,7-8H2,1H3,(H2,15,17,20)(H2,16,18,21)