1-(1,3-benzodioxol-5-ylmethyl)-3-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(6-oxidanylidene-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(6-oxo-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(6-oxo-4-propoxy-1-cyclohexa-2,4-dienylidene)methylamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(6-oxo-4-propoxycyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(6-keto-4-propoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-piperonyl-thiourea Formula: C19H21N3O4S MolecularWeight: 387.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNNC(=S)NCC2=CC3=C(C=C2)OCO3)C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNNC(=S)NCC2=CC3=C(C=C2)OCO3)C=C1

InChI

InChI=1S/C19H21N3O4S/c1-2-7-24-15-5-4-14(16(23)9-15)11-21-22-19(27)20-10-13-3-6-17-18(8-13)26-12-25-17/h3-6,8-9,11,21H,2,7,10,12H2,1H3,(H2,20,22,27)