1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(3-cyanophenyl)thiourea Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H19N3S/c1-2-3-5-14-8-10-16(11-9-14)20-18(22)21-17-7-4-6-15(12-17)13-19/h4,6-12H,2-3,5H2,1H3,(H2,20,21,22)