1-(cyclopropylmethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]thiourea

Systemtic Name: 1-(cyclopropylmethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]thiourea Openeye Name: 1-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-1-(cyclopropylmethyl)-3-ethyl-thiourea CAS Name: 1-(cyclopropylmethyl)-3-ethyl-1-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]thiourea IUPAC Name: 1-[[2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl]-1-(cyclopropylmethyl)-3-ethylthiourea Traditional Name: 1-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-1-(cyclopropylmethyl)-3-ethyl-thiourea Formula: C22H32N4O2S2 MolecularWeight: 448.64508

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N(CC1CC1)CC2=CN=C(N2CC(C)C)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCNC(=S)N(CC1CC1)CC2=CN=C(N2CC(C)C)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H32N4O2S2/c1-4-23-21(29)25(14-18-10-11-18)15-20-12-24-22(26(20)13-17(2)3)30(27,28)16-19-8-6-5-7-9-19/h5-9,12,17-18H,4,10-11,13-16H2,1-3H3,(H,23,29)