1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)amino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-(1-methyl-2-oxidanylidene-indol-3-ylidene)amino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-(1-methyl-2-oxo-indolin-3-ylidene)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-(1-methyl-2-oxo-3-indolylidene)amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(E)-(1-methyl-2-oxoindol-3-ylidene)amino]thiourea Traditional Name: 1-[(E)-(2-keto-1-methyl-indolin-3-ylidene)amino]-3-piperonyl-thiourea Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NNC(=S)NCC3=CC4=C(C=C3)OCO4)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2/C(=N\NC(=S)NCC3=CC4=C(C=C3)OCO4)/C1=O

InChI

InChI=1S/C18H16N4O3S/c1-22-13-5-3-2-4-12(13)16(17(22)23)20-21-18(26)19-9-11-6-7-14-15(8-11)25-10-24-14/h2-8H,9-10H2,1H3,(H2,19,21,26)/b20-16+