1-(cyclohex-3-en-1-ylmethyl)-3-(2-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(2-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(2-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 1-(1-cyclohex-3-enylmethyl)-3-(2-ethoxyphenyl)-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 1-(cyclohex-3-en-1-ylmethyl)-3-(2-ethoxyphenyl)-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(3-imidazol-1-ylpropyl)-3-o-phenetyl-thiourea Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N(CCCN2C=CN=C2)CC3CCC=CC3

InChI

InChI=1S/C22H30N4OS/c1-2-27-21-12-7-6-11-20(21)24-22(28)26(17-19-9-4-3-5-10-19)15-8-14-25-16-13-23-18-25/h3-4,6-7,11-13,16,18-19H,2,5,8-10,14-15,17H2,1H3,(H,24,28)