1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea

Systemtic Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea Openeye Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea CAS Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea IUPAC Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea Traditional Name: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-[(E)-1-(4-nitrophenyl)ethylideneamino]urea Formula: C17H15N5O4S MolecularWeight: 385.3971

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)NC1=NC2=C(S1)C=C(C=C2)OC)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)NC1=NC2=C(S1)C=C(C=C2)OC)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O4S/c1-10(11-3-5-12(6-4-11)22(24)25)20-21-16(23)19-17-18-14-8-7-13(26-2)9-15(14)27-17/h3-9H,1-2H3,(H2,18,19,21,23)/b20-10+