1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-3-(phenylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-benzyl-1-(cyclohex-3-en-1-ylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-3-(phenylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-benzyl-1-(cyclohex-3-en-1-ylmethyl)thiourea Traditional Name: 3-benzyl-1-(cyclohex-3-en-1-ylmethyl)-1-piperonyl-thiourea Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1CC(CC=C1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O2S/c28-23(24-14-18-7-3-1-4-8-18)25(15-19-9-5-2-6-10-19)16-20-11-12-21-22(13-20)27-17-26-21/h1-5,7-8,11-13,19H,6,9-10,14-17H2,(H,24,28)