1-butyl-1-(phenylmethyl)-3,3-bis(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-butyl-1-(phenylmethyl)-3,3-bis(4-propan-2-ylphenyl)thiourea Openeye Name: 1-benzyl-1-butyl-3,3-bis(4-isopropylphenyl)thiourea CAS Name: 1-butyl-1-(phenylmethyl)-3,3-bis(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-benzyl-1-butyl-3,3-bis(4-propan-2-ylphenyl)thiourea Traditional Name: 1-benzyl-1-butyl-3,3-bis(p-cumenyl)thiourea Formula: C30H38N2S MolecularWeight: 458.70112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=S)N(C2=CC=C(C=C2)C(C)C)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=S)N(C2=CC=C(C=C2)C(C)C)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C30H38N2S/c1-6-7-21-31(22-25-11-9-8-10-12-25)30(33)32(28-17-13-26(14-18-28)23(2)3)29-19-15-27(16-20-29)24(4)5/h8-20,23-24H,6-7,21-22H2,1-5H3