1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(3-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-piperonyl-thiourea Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=S)NCC2=CC3=C(C=C2)OCO3)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNNC(=S)NCC2=CC3=C(C=C2)OCO3)C=CC1=O

InChI

InChI=1S/C18H19N3O4S/c1-2-23-16-7-13(3-5-14(16)22)10-20-21-18(26)19-9-12-4-6-15-17(8-12)25-11-24-15/h3-8,10,20H,2,9,11H2,1H3,(H2,19,21,26)