1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-ethylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-ethylphenyl)ethylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-ethylphenyl)ethylideneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-ethylphenyl)ethylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-ethylphenyl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(4-ethylphenyl)ethylideneamino]-3-piperonyl-thiourea Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=NNC(=S)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCC1=CC=C(C=C1)/C(=N\NC(=S)NCC2=CC3=C(C=C2)OCO3)/C

InChI

InChI=1S/C19H21N3O2S/c1-3-14-4-7-16(8-5-14)13(2)21-22-19(25)20-11-15-6-9-17-18(10-15)24-12-23-17/h4-10H,3,11-12H2,1-2H3,(H2,20,22,25)/b21-13-