1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(phenylazanylcarbamothioylamino)thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(phenylazanylcarbamothioylamino)thiourea Openeye Name: 1-(anilinocarbamothioylamino)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[[(phenylhydrazo)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(anilinocarbamothioylamino)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Traditional Name: 1-(anilinothiocarbamoylamino)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)thiourea Formula: C16H17N5O2S2 MolecularWeight: 375.46848

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(C(=S)N)NC(=S)NNC3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(C(=S)N)NC(=S)NNC3=CC=CC=C3

InChI

InChI=1S/C16H17N5O2S2/c17-15(24)21(12-6-7-13-14(10-12)23-9-8-22-13)20-16(25)19-18-11-4-2-1-3-5-11/h1-7,10,18H,8-9H2,(H2,17,24)(H2,19,20,25)