1-phenethyl-3-(prop-2-enylcarbamothioylamino)thiourea

Systemtic Name: 1-phenethyl-3-(prop-2-enylcarbamothioylamino)thiourea Openeye Name: 1-allyl-3-(phenethylcarbamothioylamino)thiourea CAS Name: 1-phenethyl-3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-phenethyl-3-(prop-2-enylcarbamothioylamino)thiourea Traditional Name: 1-allyl-3-(phenethylthiocarbamoylamino)thiourea Formula: C13H18N4S2 MolecularWeight: 294.43882

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=S)NCCC1=CC=CC=C1

Isomeric SMILES

C=CCNC(=S)NNC(=S)NCCC1=CC=CC=C1

InChI

InChI=1S/C13H18N4S2/c1-2-9-14-12(18)16-17-13(19)15-10-8-11-6-4-3-5-7-11/h2-7H,1,8-10H2,(H2,14,16,18)(H2,15,17,19)