1-(1,2-benzoxazol-3-yl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(1,2-benzoxazol-3-yl)-3-(4-nitrophenyl)thiourea CAS Name: 1-(1,2-benzoxazol-3-yl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(1,2-benzoxazol-3-yl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-indoxazen-3-yl-3-(4-nitrophenyl)thiourea Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3S/c19-18(20)10-7-5-9(6-8-10)15-14(22)16-13-11-3-1-2-4-12(11)21-17-13/h1-8H,(H2,15,16,17,22)