1-(prop-2-enylcarbamothioylamino)-3-[4-[(prop-2-enylcarbamothioylamino)carbamoylamino]phenyl]urea

Systemtic Name: 1-(prop-2-enylcarbamothioylamino)-3-[4-[(prop-2-enylcarbamothioylamino)carbamoylamino]phenyl]urea Openeye Name: 1-(allylcarbamothioylamino)-3-[4-[(allylcarbamothioylamino)carbamoylamino]phenyl]urea CAS Name: 1-[4-[[oxo-[[(prop-2-enylamino)-sulfanylidenemethyl]hydrazo]methyl]amino]phenyl]-3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]urea IUPAC Name: 1-(prop-2-enylcarbamothioylamino)-3-[4-[(prop-2-enylcarbamothioylamino)carbamoylamino]phenyl]urea Traditional Name: 1-(allylthiocarbamoylamino)-3-[4-[(allylthiocarbamoylamino)carbamoylamino]phenyl]urea Formula: C16H22N8O2S2 MolecularWeight: 422.52828

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=O)NC1=CC=C(C=C1)NC(=O)NNC(=S)NCC=C

Isomeric SMILES

C=CCNC(=S)NNC(=O)NC1=CC=C(C=C1)NC(=O)NNC(=S)NCC=C

InChI

InChI=1S/C16H22N8O2S2/c1-3-9-17-15(27)23-21-13(25)19-11-5-7-12(8-6-11)20-14(26)22-24-16(28)18-10-4-2/h3-8H,1-2,9-10H2,(H2,17,23,27)(H2,18,24,28)(H2,19,21,25)(H2,20,22,26)