3-(4-bromophenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-bromophenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-bromophenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-bromophenyl)-1-(1-cyclohex-3-enylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-bromophenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-bromophenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-pyridylmethyl)thiourea Formula: C20H22BrN3S MolecularWeight: 416.37778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC(CC=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3S/c21-18-8-10-19(11-9-18)23-20(25)24(14-16-5-2-1-3-6-16)15-17-7-4-12-22-13-17/h1-2,4,7-13,16H,3,5-6,14-15H2,(H,23,25)