1-[2,6-di(butan-2-yl)phenyl]-3-hexan-2-yl-thiourea

Systemtic Name: 1-[2,6-di(butan-2-yl)phenyl]-3-hexan-2-yl-thiourea Openeye Name: 1-(2,6-disec-butylphenyl)-3-(1-methylpentyl)thiourea CAS Name: 1-[2,6-di(butan-2-yl)phenyl]-3-hexan-2-ylthiourea IUPAC Name: 1-[2,6-di(butan-2-yl)phenyl]-3-hexan-2-ylthiourea Traditional Name: 1-(2,6-disec-butylphenyl)-3-(1-methylpentyl)thiourea Formula: C21H36N2S MolecularWeight: 348.58894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC(=S)NC1=C(C=CC=C1C(C)CC)C(C)CC

Isomeric SMILES

CCCCC(C)NC(=S)NC1=C(C=CC=C1C(C)CC)C(C)CC

InChI

InChI=1S/C21H36N2S/c1-7-10-12-17(6)22-21(24)23-20-18(15(4)8-2)13-11-14-19(20)16(5)9-3/h11,13-17H,7-10,12H2,1-6H3,(H2,22,23,24)