1-[(E)-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[3-methoxy-4-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[3-methoxy-4-(3-nitrobenzyl)oxy-benzylidene]amino]thiourea Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=S)NCC=C)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=S)NCC=C)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4S/c1-3-9-20-19(28)22-21-12-14-7-8-17(18(11-14)26-2)27-13-15-5-4-6-16(10-15)23(24)25/h3-8,10-12H,1,9,13H2,2H3,(H2,20,22,28)/b21-12+