1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(2-methylprop-2-enyl)thiourea

Systemtic Name: 1-[2-(benzotriazol-1-yl)ethanoylamino]-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-(2-methylallyl)thiourea CAS Name: 1-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-[[2-(benzotriazol-1-yl)acetyl]amino]-3-(2-methylallyl)thiourea Formula: C13H16N6OS MolecularWeight: 304.37074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)NNC(=O)CN1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(=C)CNC(=S)NNC(=O)CN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H16N6OS/c1-9(2)7-14-13(21)17-16-12(20)8-19-11-6-4-3-5-10(11)15-18-19/h3-6H,1,7-8H2,2H3,(H,16,20)(H2,14,17,21)