1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-phenyl-thiourea Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=C1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC=CC=C1)/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H15N3O2S/c1-11(12-7-8-14-15(9-12)21-10-20-14)18-19-16(22)17-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H2,17,19,22)/b18-11+