1-(4-butylphenyl)-3-prop-2-ynyl-thiourea

Systemtic Name: 1-(4-butylphenyl)-3-prop-2-ynyl-thiourea Openeye Name: 1-(4-butylphenyl)-3-prop-2-ynyl-thiourea CAS Name: 1-(4-butylphenyl)-3-prop-2-ynylthiourea IUPAC Name: 1-(4-butylphenyl)-3-prop-2-ynylthiourea Traditional Name: 1-(4-butylphenyl)-3-propargyl-thiourea Formula: C14H18N2S MolecularWeight: 246.37112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC#C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC#C

InChI

InChI=1S/C14H18N2S/c1-3-5-6-12-7-9-13(10-8-12)16-14(17)15-11-4-2/h2,7-10H,3,5-6,11H2,1H3,(H2,15,16,17)