1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(2-nitrophenyl)thiourea

Systemtic Name: 1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-3-(2-nitrophenyl)thiourea Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C=NNC(=S)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)/C=N\NC(=S)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c21-20(22)13-4-2-1-3-12(13)18-16(25)19-17-10-11-5-6-14-15(9-11)24-8-7-23-14/h1-6,9-10H,7-8H2,(H2,18,19,25)/b17-10-