1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(3-keto-4H-1,4-benzoxazin-6-yl)ethylideneamino]-3-piperonyl-thiourea Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC2=C(C=C1)OCO2)/C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C19H18N4O4S/c1-11(13-3-5-15-14(7-13)21-18(24)9-25-15)22-23-19(28)20-8-12-2-4-16-17(6-12)27-10-26-16/h2-7H,8-10H2,1H3,(H,21,24)(H2,20,23,28)/b22-11-