1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-chlorophenyl)propylideneamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-chlorophenyl)propylideneamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-chlorophenyl)propylideneamino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-chlorophenyl)propylideneamino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(Z)-1-(4-chlorophenyl)propylideneamino]thiourea Traditional Name: 1-[(Z)-1-(4-chlorophenyl)propylideneamino]-3-piperonyl-thiourea Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC/C(=N/NC(=S)NCC1=CC2=C(C=C1)OCO2)/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-2-15(13-4-6-14(19)7-5-13)21-22-18(25)20-10-12-3-8-16-17(9-12)24-11-23-16/h3-9H,2,10-11H2,1H3,(H2,20,22,25)/b21-15-