1-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]benzylidene]amino]-3-phenyl-thiourea Formula: C19H18N6O3S MolecularWeight: 410.44962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=S)NC2=CC=CC=C2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=S)NC2=CC=CC=C2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N6O3S/c1-28-18-8-7-14(9-15(18)12-24-13-17(11-21-24)25(26)27)10-20-23-19(29)22-16-5-3-2-4-6-16/h2-11,13H,12H2,1H3,(H2,22,23,29)/b20-10+