1-butyl-3-[(E)-(4-cyanophenyl)methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(E)-(4-cyanophenyl)methylideneamino]thiourea Openeye Name: 1-butyl-3-[(E)-(4-cyanophenyl)methyleneamino]thiourea CAS Name: 1-butyl-3-[(E)-(4-cyanophenyl)methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(E)-(4-cyanophenyl)methylideneamino]thiourea Traditional Name: 1-butyl-3-[(E)-(4-cyanobenzylidene)amino]thiourea Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCNC(=S)N/N=C/C1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H16N4S/c1-2-3-8-15-13(18)17-16-10-12-6-4-11(9-14)5-7-12/h4-7,10H,2-3,8H2,1H3,(H2,15,17,18)/b16-10+