3-(4-butan-2-ylphenyl)-1,1-dipentyl-thiourea

Systemtic Name: 3-(4-butan-2-ylphenyl)-1,1-dipentyl-thiourea Openeye Name: 1,1-dipentyl-3-(4-sec-butylphenyl)thiourea CAS Name: 3-(4-butan-2-ylphenyl)-1,1-dipentylthiourea IUPAC Name: 3-(4-butan-2-ylphenyl)-1,1-dipentylthiourea Traditional Name: 1,1-diamyl-3-(4-sec-butylphenyl)thiourea Formula: C21H36N2S MolecularWeight: 348.58894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=S)NC1=CC=C(C=C1)C(C)CC

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=CC=C(C=C1)C(C)CC

InChI

InChI=1S/C21H36N2S/c1-5-8-10-16-23(17-11-9-6-2)21(24)22-20-14-12-19(13-15-20)18(4)7-3/h12-15,18H,5-11,16-17H2,1-4H3,(H,22,24)