1-(4-butan-2-ylphenyl)-3-heptyl-thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-heptyl-thiourea Openeye Name: 1-heptyl-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-heptylthiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-heptylthiourea Traditional Name: 1-heptyl-3-(4-sec-butylphenyl)thiourea Formula: C18H30N2S MolecularWeight: 306.5092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC1=CC=C(C=C1)C(C)CC

Isomeric SMILES

CCCCCCCNC(=S)NC1=CC=C(C=C1)C(C)CC

InChI

InChI=1S/C18H30N2S/c1-4-6-7-8-9-14-19-18(21)20-17-12-10-16(11-13-17)15(3)5-2/h10-13,15H,4-9,14H2,1-3H3,(H2,19,20,21)